3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-4H-isochromen-1-one hydrochloride

Systemtic Name: 3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-4H-isochromen-1-one hydrochloride Openeye Name: 3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)isochroman-1-one hydrochloride CAS Name: 3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-3,4-dihydro-1H-2-benzopyran-1-one hydrochloride IUPAC Name: 3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)-4H-isochromen-1-one hydrochloride Traditional Name: 3-(4-chlorophenyl)-3-(2-dimethylaminoethyl)isochroman-1-one hydrochloride Formula: C19H21Cl2NO2 MolecularWeight: 366.28154

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1(CC2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)Cl.Cl

Isomeric SMILES

CN(C)CCC1(CC2=CC=CC=C2C(=O)O1)C3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C19H20ClNO2.ClH/c1-21(2)12-11-19(15-7-9-16(20)10-8-15)13-14-5-3-4-6-17(14)18(22)23-19;/h3-10H,11-13H2,1-2H3;1H