[2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate

Systemtic Name: [2-[(3-chloranyl-4-cyano-phenyl)amino]-2-oxidanylidene-ethyl] 2-[(phenylmethyl)carbamoylamino]ethanoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-2-oxo-ethyl] 2-(benzylcarbamoylamino)acetate CAS Name: 2-[[oxo-[(phenylmethyl)amino]methyl]amino]acetic acid [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 2-(benzylcarbamoylamino)acetate Traditional Name: 2-(benzylcarbamoylamino)acetic acid [2-(3-chloro-4-cyano-anilino)-2-keto-ethyl] ester Formula: C19H17ClN4O4 MolecularWeight: 400.81568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NCC(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NCC(=O)OCC(=O)NC2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C19H17ClN4O4/c20-16-8-15(7-6-14(16)9-21)24-17(25)12-28-18(26)11-23-19(27)22-10-13-4-2-1-3-5-13/h1-8H,10-12H2,(H,24,25)(H2,22,23,27)