bis(phenylmethyl) 2-[bis(azanyl)methylideneamino]-2-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[bis(azanyl)methylideneamino]-2-[(1-methoxy-1-oxidanylidene-3-phenyl-propan-2-yl)amino]propanedioate Openeye Name: dibenzyl 2-[(1-benzyl-2-methoxy-2-oxo-ethyl)amino]-2-guanidino-propanedioate CAS Name: 2-(diaminomethylideneamino)-2-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-(diaminomethylideneamino)-2-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)amino]propanedioate Traditional Name: 2-[(1-benzyl-2-keto-2-methoxy-ethyl)amino]-2-guanidino-malonic acid dibenzyl ester Formula: C28H30N4O6 MolecularWeight: 518.561

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(C(=O)OCC2=CC=CC=C2)(C(=O)OCC3=CC=CC=C3)N=C(N)N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(C(=O)OCC2=CC=CC=C2)(C(=O)OCC3=CC=CC=C3)N=C(N)N

InChI

InChI=1S/C28H30N4O6/c1-36-24(33)23(17-20-11-5-2-6-12-20)31-28(32-27(29)30,25(34)37-18-21-13-7-3-8-14-21)26(35)38-19-22-15-9-4-10-16-22/h2-16,23,31H,17-19H2,1H3,(H4,29,30,32)