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

Systemtic Name: cyanomethyl 2-[1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]ethanoate Openeye Name: cyanomethyl 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate CAS Name: 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetate Traditional Name: 2-(1,3-diketo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetic acid cyanomethyl ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC2C1C(=O)N(C2=O)CC(=O)OCC#N

Isomeric SMILES

C1C=CCC2C1C(=O)N(C2=O)CC(=O)OCC#N

InChI

InChI=1S/C12H12N2O4/c13-5-6-18-10(15)7-14-11(16)8-3-1-2-4-9(8)12(14)17/h1-2,8-9H,3-4,6-7H2