[(4-azanyl-4-oxidanylidene-butanoyl)amino] 2-phenylethanoate

Systemtic Name: [(4-azanyl-4-oxidanylidene-butanoyl)amino] 2-phenylethanoate Openeye Name: [(4-amino-4-oxo-butanoyl)amino] 2-phenylacetate CAS Name: 2-phenylacetic acid [(4-amino-1,4-dioxobutyl)amino] ester IUPAC Name: [(4-amino-4-oxobutanoyl)amino] 2-phenylacetate Traditional Name: 2-phenylacetic acid [(4-amino-4-keto-butanoyl)amino] ester Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)ONC(=O)CCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)ONC(=O)CCC(=O)N

InChI

InChI=1S/C12H14N2O4/c13-10(15)6-7-11(16)14-18-12(17)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H2,13,15)(H,14,16)