2-[2-(3-carbamimidoylphenoxy)ethyl-[4-(2-sulfamoylphenyl)phenyl]carbonyl-amino]ethanoic acid

Systemtic Name: 2-[2-(3-carbamimidoylphenoxy)ethyl-[4-(2-sulfamoylphenyl)phenyl]carbonyl-amino]ethanoic acid Openeye Name: 2-[2-(3-carbamimidoylphenoxy)ethyl-[4-(2-sulfamoylphenyl)benzoyl]amino]acetic acid CAS Name: 2-[2-(3-carbamimidoylphenoxy)ethyl-[oxo-[4-(2-sulfamoylphenyl)phenyl]methyl]amino]acetic acid IUPAC Name: 2-[2-(3-carbamimidoylphenoxy)ethyl-[4-(2-sulfamoylphenyl)benzoyl]amino]acetic acid Traditional Name: 2-[2-(3-amidinophenoxy)ethyl-[4-(2-sulfamoylphenyl)benzoyl]amino]acetic acid Formula: C24H24N4O6S MolecularWeight: 496.53556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)N(CCOC3=CC=CC(=C3)C(=N)N)CC(=O)O)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)N(CCOC3=CC=CC(=C3)C(=N)N)CC(=O)O)S(=O)(=O)N

InChI

InChI=1S/C24H24N4O6S/c25-23(26)18-4-3-5-19(14-18)34-13-12-28(15-22(29)30)24(31)17-10-8-16(9-11-17)20-6-1-2-7-21(20)35(27,32)33/h1-11,14H,12-13,15H2,(H3,25,26)(H,29,30)(H2,27,32,33)