2-(2-dimethylaminoethyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrochloride

Systemtic Name: 2-(2-dimethylaminoethyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrochloride Openeye Name: 2-(2-dimethylaminoethyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrochloride CAS Name: 2-(2-dimethylaminoethyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrochloride IUPAC Name: 2-(2-dimethylaminoethyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-dione hydrochloride Traditional Name: 2-(2-dimethylaminoethyl)-4,7-diphenyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone hydrochloride Formula: C24H27ClN2O2 MolecularWeight: 410.93638

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C(=O)C2C(C=CC(C2C1=O)C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

CN(C)CCN1C(=O)C2C(C=CC(C2C1=O)C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C24H26N2O2.ClH/c1-25(2)15-16-26-23(27)21-19(17-9-5-3-6-10-17)13-14-20(22(21)24(26)28)18-11-7-4-8-12-18;/h3-14,19-22H,15-16H2,1-2H3;1H