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

Systemtic Name: methyl 3-(3-carbamimidoylphenyl)-5-[[(4-methoxycarbonylphenyl)carbonylamino]methyl]benzoate Openeye Name: methyl 3-(3-carbamimidoylphenyl)-5-[[(4-methoxycarbonylbenzoyl)amino]methyl]benzoate CAS Name: 3-(3-carbamimidoylphenyl)-5-[[[(4-methoxycarbonylphenyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-carbamimidoylphenyl)-5-[[(4-methoxycarbonylbenzoyl)amino]methyl]benzoate Traditional Name: 3-(3-amidinophenyl)-5-[[(4-carbomethoxybenzoyl)amino]methyl]benzoic acid methyl ester Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O5/c1-32-24(30)17-8-6-16(7-9-17)23(29)28-14-15-10-20(13-21(11-15)25(31)33-2)18-4-3-5-19(12-18)22(26)27/h3-13H,14H2,1-2H3,(H3,26,27)(H,28,29)