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

Systemtic Name: 1-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]propan-2-yl ethanoate Openeye Name: [2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-1-methyl-ethyl] acetate CAS Name: acetic acid 1-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)propan-2-yl ester IUPAC Name: 1-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)propan-2-yl acetate Traditional Name: acetic acid [2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)-1-methyl-ethyl] ester Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2CC=CCC2C1=O)OC(=O)C

Isomeric SMILES

CC(CN1C(=O)C2CC=CCC2C1=O)OC(=O)C

InChI

InChI=1S/C13H17NO4/c1-8(18-9(2)15)7-14-12(16)10-5-3-4-6-11(10)13(14)17/h3-4,8,10-11H,5-7H2,1-2H3