2-phenyl-3-pyrrolidin-1-yl-1-(3,4,5-trimethoxyphenyl)propan-1-one hydrochloride

Systemtic Name: 2-phenyl-3-pyrrolidin-1-yl-1-(3,4,5-trimethoxyphenyl)propan-1-one hydrochloride Openeye Name: 2-phenyl-3-pyrrolidin-1-yl-1-(3,4,5-trimethoxyphenyl)propan-1-one hydrochloride CAS Name: 2-phenyl-3-(1-pyrrolidinyl)-1-(3,4,5-trimethoxyphenyl)-1-propanone hydrochloride IUPAC Name: 2-phenyl-3-pyrrolidin-1-yl-1-(3,4,5-trimethoxyphenyl)propan-1-one hydrochloride Traditional Name: 2-phenyl-3-pyrrolidino-1-(3,4,5-trimethoxyphenyl)propan-1-one hydrochloride Formula: C22H28ClNO4 MolecularWeight: 405.91502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C(CN2CCCC2)C3=CC=CC=C3.Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C(CN2CCCC2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C22H27NO4.ClH/c1-25-19-13-17(14-20(26-2)22(19)27-3)21(24)18(15-23-11-7-8-12-23)16-9-5-4-6-10-16;/h4-6,9-10,13-14,18H,7-8,11-12,15H2,1-3H3;1H