ethanoic acid; 2-(4-methylphenyl)-3H-isoindol-1-one

Systemtic Name: ethanoic acid; 2-(4-methylphenyl)-3H-isoindol-1-one Openeye Name: acetic acid; 2-(p-tolyl)isoindolin-1-one CAS Name: acetic acid; 2-(4-methylphenyl)-3H-isoindol-1-one IUPAC Name: acetic acid; 2-(4-methylphenyl)-3H-isoindol-1-one Traditional Name: acetic acid; 2-(p-tolyl)isoindolin-1-one Formula: C17H17NO3 MolecularWeight: 283.32178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O.CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)N2CC3=CC=CC=C3C2=O.CC(=O)O

InChI

InChI=1S/C15H13NO.C2H4O2/c1-11-6-8-13(9-7-11)16-10-12-4-2-3-5-14(12)15(16)17;1-2(3)4/h2-9H,10H2,1H3;1H3,(H,3,4)