methyl 3-(3-carbamimidoylphenyl)-5-[[[4-(methylamino)phenyl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 3-(3-carbamimidoylphenyl)-5-[[[4-(methylamino)phenyl]carbonylamino]methyl]benzoate Openeye Name: methyl 3-(3-carbamimidoylphenyl)-5-[[[4-(methylamino)benzoyl]amino]methyl]benzoate CAS Name: 3-(3-carbamimidoylphenyl)-5-[[[[4-(methylamino)phenyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-carbamimidoylphenyl)-5-[[[4-(methylamino)benzoyl]amino]methyl]benzoate Traditional Name: 3-(3-amidinophenyl)-5-[[[4-(methylamino)benzoyl]amino]methyl]benzoic acid methyl ester Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC=C(C=C1)C(=O)NCC2=CC(=CC(=C2)C(=O)OC)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

CNC1=CC=C(C=C1)C(=O)NCC2=CC(=CC(=C2)C(=O)OC)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C24H24N4O3/c1-27-21-8-6-16(7-9-21)23(29)28-14-15-10-19(13-20(11-15)24(30)31-2)17-4-3-5-18(12-17)22(25)26/h3-13,27H,14H2,1-2H3,(H3,25,26)(H,28,29)