2-[2-cyanoethanoyl-[(phenylmethyl)carbamoyl]amino]ethyl ethanoate

Systemtic Name: 2-[2-cyanoethanoyl-[(phenylmethyl)carbamoyl]amino]ethyl ethanoate Openeye Name: 2-[benzylcarbamoyl-(2-cyanoacetyl)amino]ethyl acetate CAS Name: acetic acid 2-[(2-cyano-1-oxoethyl)-[oxo-[(phenylmethyl)amino]methyl]amino]ethyl ester IUPAC Name: 2-[benzylcarbamoyl-(2-cyanoacetyl)amino]ethyl acetate Traditional Name: acetic acid 2-[benzylcarbamoyl-(2-cyanoacetyl)amino]ethyl ester Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(C(=O)CC#N)C(=O)NCC1=CC=CC=C1

Isomeric SMILES

CC(=O)OCCN(C(=O)CC#N)C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C15H17N3O4/c1-12(19)22-10-9-18(14(20)7-8-16)15(21)17-11-13-5-3-2-4-6-13/h2-6H,7,9-11H2,1H3,(H,17,21)