[3a,7a-dimethyl-1,3-bis(oxidanylidene)-2-phenyl-4,5,6,7-tetrahydroisoindol-4-yl] ethanoate

Systemtic Name: [3a,7a-dimethyl-1,3-bis(oxidanylidene)-2-phenyl-4,5,6,7-tetrahydroisoindol-4-yl] ethanoate Openeye Name: (3a,7a-dimethyl-1,3-dioxo-2-phenyl-4,5,6,7-tetrahydroisoindol-4-yl) acetate CAS Name: acetic acid (3a,7a-dimethyl-1,3-dioxo-2-phenyl-4,5,6,7-tetrahydroisoindol-4-yl) ester IUPAC Name: (3a,7a-dimethyl-1,3-dioxo-2-phenyl-4,5,6,7-tetrahydroisoindol-4-yl) acetate Traditional Name: acetic acid (1,3-diketo-3a,7a-dimethyl-2-phenyl-4,5,6,7-tetrahydroisoindol-4-yl) ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCC2(C1(C(=O)N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC(=O)OC1CCCC2(C1(C(=O)N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C18H21NO4/c1-12(20)23-14-10-7-11-17(2)15(21)19(16(22)18(14,17)3)13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-11H2,1-3H3