[2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] benzoate

Systemtic Name: [2-[bis(2-cyanoethyl)amino]-2-oxidanylidene-ethyl] benzoate Openeye Name: [2-[bis(2-cyanoethyl)amino]-2-oxo-ethyl] benzoate CAS Name: benzoic acid [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[bis(2-cyanoethyl)amino]-2-oxoethyl] benzoate Traditional Name: benzoic acid [2-[bis(2-cyanoethyl)amino]-2-keto-ethyl] ester Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCC(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCC(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C15H15N3O3/c16-8-4-10-18(11-5-9-17)14(19)12-21-15(20)13-6-2-1-3-7-13/h1-3,6-7H,4-5,10-12H2