(phenylmethyl) 3-[[3-[(4-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[[3-[(4-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]propanoate Openeye Name: benzyl 3-[[3-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]propanoate CAS Name: 3-[[[3-[[(4-carbamimidoylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[3-[(4-carbamimidoylbenzoyl)amino]benzoyl]amino]propanoate Traditional Name: 3-[[3-[(4-amidinobenzoyl)amino]benzoyl]amino]propionic acid benzyl ester Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCNC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H24N4O4/c26-23(27)18-9-11-19(12-10-18)25(32)29-21-8-4-7-20(15-21)24(31)28-14-13-22(30)33-16-17-5-2-1-3-6-17/h1-12,15H,13-14,16H2,(H3,26,27)(H,28,31)(H,29,32)