(E)-3-(2-chlorophenyl)-1-[3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one hydrochloride

Systemtic Name: (E)-3-(2-chlorophenyl)-1-[3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one hydrochloride Openeye Name: (E)-3-(2-chlorophenyl)-1-[3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one hydrochloride CAS Name: (E)-3-(2-chlorophenyl)-1-[3,5-dimethyl-4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-2-propen-1-one hydrochloride IUPAC Name: (E)-3-(2-chlorophenyl)-1-[3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)phenyl]prop-2-en-1-one hydrochloride Traditional Name: (E)-3-(2-chlorophenyl)-1-[3,5-dimethyl-4-(2-pyrrolidinoethoxy)phenyl]prop-2-en-1-one hydrochloride Formula: C23H27Cl2NO2 MolecularWeight: 420.37198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCN2CCCC2)C)C(=O)C=CC3=CC=CC=C3Cl.Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCCN2CCCC2)C)C(=O)/C=C/C3=CC=CC=C3Cl.Cl

InChI

InChI=1S/C23H26ClNO2.ClH/c1-17-15-20(22(26)10-9-19-7-3-4-8-21(19)24)16-18(2)23(17)27-14-13-25-11-5-6-12-25;/h3-4,7-10,15-16H,5-6,11-14H2,1-2H3;1H/b10-9+;