(phenylmethyl) 4-[[4-[(Z)-N'-acetyloxycarbamimidoyl]phenyl]methylamino]-3-azanyl-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 4-[[4-[(Z)-N'-acetyloxycarbamimidoyl]phenyl]methylamino]-3-azanyl-4-oxidanylidene-butanoate Openeye Name: benzyl 4-[[4-[(Z)-N'-acetoxycarbamimidoyl]phenyl]methylamino]-3-amino-4-oxo-butanoate CAS Name: 4-[[4-[(Z)-acetyloxyimino(amino)methyl]phenyl]methylamino]-3-amino-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[[4-[(Z)-N'-acetyloxycarbamimidoyl]phenyl]methylamino]-3-amino-4-oxobutanoate Traditional Name: 4-[[4-[(Z)-N'-acetoxyamidino]benzyl]amino]-3-amino-4-keto-butyric acid benzyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON=C(C1=CC=C(C=C1)CNC(=O)C(CC(=O)OCC2=CC=CC=C2)N)N

Isomeric SMILES

CC(=O)O/N=C(/C1=CC=C(C=C1)CNC(=O)C(CC(=O)OCC2=CC=CC=C2)N)\N

InChI

InChI=1S/C21H24N4O5/c1-14(26)30-25-20(23)17-9-7-15(8-10-17)12-24-21(28)18(22)11-19(27)29-13-16-5-3-2-4-6-16/h2-10,18H,11-13,22H2,1H3,(H2,23,25)(H,24,28)