1-[2-(6-carbamimidoylnaphthalen-2-yl)oxy-5-(methylsulfonylamino)phenyl]naphthalene-2-carboxylic acid

Systemtic Name: 1-[2-(6-carbamimidoylnaphthalen-2-yl)oxy-5-(methylsulfonylamino)phenyl]naphthalene-2-carboxylic acid Openeye Name: 1-[2-[(6-carbamimidoyl-2-naphthyl)oxy]-5-(methanesulfonamido)phenyl]naphthalene-2-carboxylic acid CAS Name: 1-[2-[(6-carbamimidoyl-2-naphthalenyl)oxy]-5-(methanesulfonamido)phenyl]-2-naphthalenecarboxylic acid IUPAC Name: 1-[2-(6-carbamimidoylnaphthalen-2-yl)oxy-5-(methanesulfonamido)phenyl]naphthalene-2-carboxylic acid Traditional Name: 1-[2-(6-amidino-2-naphthoxy)-5-(methanesulfonamido)phenyl]-2-naphthoic acid Formula: C29H23N3O5S MolecularWeight: 525.57502

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC(=C(C=C1)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)C4=C(C=CC5=CC=CC=C54)C(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC(=C(C=C1)OC2=CC3=C(C=C2)C=C(C=C3)C(=N)N)C4=C(C=CC5=CC=CC=C54)C(=O)O

InChI

InChI=1S/C29H23N3O5S/c1-38(35,36)32-21-10-13-26(37-22-11-8-18-14-20(28(30)31)7-6-19(18)15-22)25(16-21)27-23-5-3-2-4-17(23)9-12-24(27)29(33)34/h2-16,32H,1H3,(H3,30,31)(H,33,34)