[4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]phenyl] ethanoate

Systemtic Name: [4-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]phenyl] ethanoate Openeye Name: [4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)phenyl] acetate CAS Name: acetic acid [4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)phenyl] ester IUPAC Name: [4-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)phenyl] acetate Traditional Name: acetic acid [4-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)phenyl] ester Formula: C16H15NO4 MolecularWeight: 285.2946

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)N2C(=O)C3CC=CCC3C2=O

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)N2C(=O)C3CC=CCC3C2=O

InChI

InChI=1S/C16H15NO4/c1-10(18)21-12-8-6-11(7-9-12)17-15(19)13-4-2-3-5-14(13)16(17)20/h2-3,6-9,13-14H,4-5H2,1H3