Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: Diphenylpyraline Hydrochloride
CAS No.: 132-18-3
Molecular formula: C19H24ClNO
Molecular weight: 317.9 g/mol
SMILES: CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3.Cl
Structural class:
Other identifiers:

4-diphenylmethoxy-1-methylpiperidine

diphenylpyraline

diphenylpyraline hydrochloride

diphenylpyraline maleate (2:1)

Lergobine

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 250mg 98% 160 RT in stock -
Kehua Intelligence 1g 98% 336 RT in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4-benzhydryloxy-1-methylpiperidine;hydrochloride


4.2 InChI

InChI=1S/C19H23NO.ClH/c1-20-14-12-18(13-15-20)21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17;/h2-11,18-19H,12-15H2,1H3;1H


4.3 InChIKey

LPRLDRXGWKXRMQ-UHFFFAOYSA-N


4.4 Canonical SMILES

CN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3.Cl


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon
-- No 3D model data available --