methyl 4-[[(E)-N,N'-bis(phenylmethoxycarbonyl)carbamimidoyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-N,N'-bis(phenylmethoxycarbonyl)carbamimidoyl]amino]benzoate Openeye Name: methyl 4-[[(E)-N,N'-bis(benzyloxycarbonyl)carbamimidoyl]amino]benzoate CAS Name: 4-[[(E)-phenylmethoxycarbonylamino(phenylmethoxycarbonylimino)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-N,N'-bis(phenylmethoxycarbonyl)carbamimidoyl]amino]benzoate Traditional Name: 4-[[(E)-N,N'-dicarbobenzoxyamidino]amino]benzoic acid methyl ester Formula: C25H23N3O6 MolecularWeight: 461.46662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O6/c1-32-22(29)20-12-14-21(15-13-20)26-23(27-24(30)33-16-18-8-4-2-5-9-18)28-25(31)34-17-19-10-6-3-7-11-19/h2-15H,16-17H2,1H3,(H2,26,27,28,30,31)