[2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-(cyclopropylamino)-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-(cyclopropylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylamino)-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-(cyclopropylamino)-2-keto-ethyl] ester Formula: C13H12N2O3 MolecularWeight: 244.24598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)COC(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

C1CC1NC(=O)COC(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H12N2O3/c14-7-9-2-1-3-10(6-9)13(17)18-8-12(16)15-11-4-5-11/h1-3,6,11H,4-5,8H2,(H,15,16)