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

Systemtic Name: 2-[[(4-ethanoylphenyl)amino]methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[(4-acetylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[(4-acetylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[(4-acetylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[(4-acetylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C17H18N2O3 MolecularWeight: 298.33642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3/c1-11(20)12-6-8-13(9-7-12)18-10-19-16(21)14-4-2-3-5-15(14)17(19)22/h2-3,6-9,14-15,18H,4-5,10H2,1H3