[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[(3-fluorophenyl)carbonylamino]ethanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-[(3-fluorophenyl)carbonylamino]ethanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-[(3-fluorobenzoyl)amino]acetate CAS Name: 2-[[(3-fluorophenyl)-oxomethyl]amino]acetic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-[(3-fluorobenzoyl)amino]acetate Traditional Name: 2-[(3-fluorobenzoyl)amino]acetic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H14FN3O4 MolecularWeight: 307.277063

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(=O)NCC(=O)OCC(=O)NCCC#N

Isomeric SMILES

C1=CC(=CC(=C1)F)C(=O)NCC(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C14H14FN3O4/c15-11-4-1-3-10(7-11)14(21)18-8-13(20)22-9-12(19)17-6-2-5-16/h1,3-4,7H,2,6,8-9H2,(H,17,19)(H,18,21)