(phenylmethyl) 3-azanyl-4-(1H-imidazol-5-yl)-2-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 3-azanyl-4-(1H-imidazol-5-yl)-2-oxidanylidene-butanoate Openeye Name: benzyl 3-amino-4-(1H-imidazol-5-yl)-2-oxo-butanoate CAS Name: 3-amino-4-(1H-imidazol-5-yl)-2-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-4-(1H-imidazol-5-yl)-2-oxobutanoate Traditional Name: 3-amino-4-(1H-imidazol-5-yl)-2-keto-butyric acid benzyl ester Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(=O)C(CC2=CN=CN2)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(=O)C(CC2=CN=CN2)N

InChI

InChI=1S/C14H15N3O3/c15-12(6-11-7-16-9-17-11)13(18)14(19)20-8-10-4-2-1-3-5-10/h1-5,7,9,12H,6,8,15H2,(H,16,17)