[1-(cyanomethyl)-2,5-bis(oxidanylidene)-4-(phenylcarbonyloxy)pyrrolidin-3-yl] benzoate

Systemtic Name: [1-(cyanomethyl)-2,5-bis(oxidanylidene)-4-(phenylcarbonyloxy)pyrrolidin-3-yl] benzoate Openeye Name: [4-benzoyloxy-1-(cyanomethyl)-2,5-dioxo-pyrrolidin-3-yl] benzoate CAS Name: benzoic acid [4-benzoyloxy-1-(cyanomethyl)-2,5-dioxo-3-pyrrolidinyl] ester IUPAC Name: [4-benzoyloxy-1-(cyanomethyl)-2,5-dioxopyrrolidin-3-yl] benzoate Traditional Name: benzoic acid [4-benzoyloxy-1-(cyanomethyl)-2,5-diketo-pyrrolidin-3-yl] ester Formula: C20H14N2O6 MolecularWeight: 378.33496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2C(C(=O)N(C2=O)CC#N)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2C(C(=O)N(C2=O)CC#N)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H14N2O6/c21-11-12-22-17(23)15(27-19(25)13-7-3-1-4-8-13)16(18(22)24)28-20(26)14-9-5-2-6-10-14/h1-10,15-16H,12H2