[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-(dimethylamino)benzoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 3-(dimethylamino)benzoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 3-(dimethylamino)benzoate CAS Name: 3-(dimethylamino)benzoic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 3-(dimethylamino)benzoate Traditional Name: 3-(dimethylamino)benzoic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H17N3O3 MolecularWeight: 275.30308

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H17N3O3/c1-17(2)12-6-3-5-11(9-12)14(19)20-10-13(18)16-8-4-7-15/h3,5-6,9H,4,8,10H2,1-2H3,(H,16,18)