2-[[(4-methylphenyl)amino]methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[[(4-methylphenyl)amino]methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(4-methylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[(4-methylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(4-methylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-(p-toluidinomethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H18N2O2 MolecularWeight: 270.32632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCN2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)NCN2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C16H18N2O2/c1-11-6-8-12(9-7-11)17-10-18-15(19)13-4-2-3-5-14(13)16(18)20/h2-3,6-9,13-14,17H,4-5,10H2,1H3