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

Systemtic Name: 5-chloranyl-2-[[(4-methylphenyl)amino]methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 5-chloro-2-[(4-methylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 5-chloro-2-[(4-methylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 5-chloro-2-[(4-methylanilino)methyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 5-chloro-2-(p-toluidinomethyl)-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCN2C(=O)C3CC=C(CC3C2=O)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NCN2C(=O)C3CC=C(CC3C2=O)Cl

InChI

InChI=1S/C16H17ClN2O2/c1-10-2-5-12(6-3-10)18-9-19-15(20)13-7-4-11(17)8-14(13)16(19)21/h2-6,13-14,18H,7-9H2,1H3