5,6-dimethyl-2-(4-piperidin-1-ylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 5,6-dimethyl-2-(4-piperidin-1-ylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 5,6-dimethyl-2-[4-(1-piperidyl)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 5,6-dimethyl-2-[4-(1-piperidinyl)phenyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 5,6-dimethyl-2-(4-piperidin-1-ylphenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 5,6-dimethyl-2-(4-piperidinophenyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)N4CCCCC4)C

Isomeric SMILES

CC1=C(CC2C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)N4CCCCC4)C

InChI

InChI=1S/C21H26N2O2/c1-14-12-18-19(13-15(14)2)21(25)23(20(18)24)17-8-6-16(7-9-17)22-10-4-3-5-11-22/h6-9,18-19H,3-5,10-13H2,1-2H3