2-[2-(6-carbamimidoylnaphthalen-2-yl)oxy-5-(methylsulfonylamino)phenyl]-5-(2-methylpropylcarbamoyl)benzoic acid

Systemtic Name: 2-[2-(6-carbamimidoylnaphthalen-2-yl)oxy-5-(methylsulfonylamino)phenyl]-5-(2-methylpropylcarbamoyl)benzoic acid Openeye Name: 2-[2-[(6-carbamimidoyl-2-naphthyl)oxy]-5-(methanesulfonamido)phenyl]-5-(isobutylcarbamoyl)benzoic acid CAS Name: 2-[2-[(6-carbamimidoyl-2-naphthalenyl)oxy]-5-(methanesulfonamido)phenyl]-5-[(2-methylpropylamino)-oxomethyl]benzoic acid IUPAC Name: 2-[2-(6-carbamimidoylnaphthalen-2-yl)oxy-5-(methanesulfonamido)phenyl]-5-(2-methylpropylcarbamoyl)benzoic acid Traditional Name: 2-[2-(6-amidino-2-naphthoxy)-5-(methanesulfonamido)phenyl]-5-(isobutylcarbamoyl)benzoic acid Formula: C30H30N4O6S MolecularWeight: 574.6474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=CC(=C2)NS(=O)(=O)C)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N)C(=O)O

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=CC(=C2)NS(=O)(=O)C)OC3=CC4=C(C=C3)C=C(C=C4)C(=N)N)C(=O)O

InChI

InChI=1S/C30H30N4O6S/c1-17(2)16-33-29(35)21-7-10-24(26(14-21)30(36)37)25-15-22(34-41(3,38)39)8-11-27(25)40-23-9-6-18-12-20(28(31)32)5-4-19(18)13-23/h4-15,17,34H,16H2,1-3H3,(H3,31,32)(H,33,35)(H,36,37)