(E)-1-[3,5-bis(dimethylaminomethyl)-4-oxidanyl-phenyl]-3-(2-chlorophenyl)prop-2-en-1-one hydrochloride

Systemtic Name: (E)-1-[3,5-bis(dimethylaminomethyl)-4-oxidanyl-phenyl]-3-(2-chlorophenyl)prop-2-en-1-one hydrochloride Openeye Name: (E)-1-[3,5-bis(dimethylaminomethyl)-4-hydroxy-phenyl]-3-(2-chlorophenyl)prop-2-en-1-one hydrochloride CAS Name: (E)-1-[3,5-bis(dimethylaminomethyl)-4-hydroxyphenyl]-3-(2-chlorophenyl)-2-propen-1-one hydrochloride IUPAC Name: (E)-1-[3,5-bis(dimethylaminomethyl)-4-hydroxyphenyl]-3-(2-chlorophenyl)prop-2-en-1-one hydrochloride Traditional Name: (E)-1-[3,5-bis(dimethylaminomethyl)-4-hydroxy-phenyl]-3-(2-chlorophenyl)prop-2-en-1-one hydrochloride Formula: C21H26Cl2N2O2 MolecularWeight: 409.34934

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC(=C1O)CN(C)C)C(=O)C=CC2=CC=CC=C2Cl.Cl

Isomeric SMILES

CN(C)CC1=CC(=CC(=C1O)CN(C)C)C(=O)/C=C/C2=CC=CC=C2Cl.Cl

InChI

InChI=1S/C21H25ClN2O2.ClH/c1-23(2)13-17-11-16(12-18(21(17)26)14-24(3)4)20(25)10-9-15-7-5-6-8-19(15)22;/h5-12,26H,13-14H2,1-4H3;1H/b10-9+;