2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]-1-oxidanyl-ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]-1-oxidanyl-ethyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]-1-hydroxy-ethyl]phenoxy]acetic acid CAS Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]-1-hydroxyethyl]phenoxy]acetic acid IUPAC Name: 2-[4-[2-[(4-carbamimidoylphenyl)sulfonylamino]-1-hydroxyethyl]phenoxy]acetic acid Traditional Name: 2-[4-[2-[(4-amidinophenyl)sulfonylamino]-1-hydroxy-ethyl]phenoxy]acetic acid Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CNS(=O)(=O)C2=CC=C(C=C2)C(=N)N)O)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(CNS(=O)(=O)C2=CC=C(C=C2)C(=N)N)O)OCC(=O)O

InChI

InChI=1S/C17H19N3O6S/c18-17(19)12-3-7-14(8-4-12)27(24,25)20-9-15(21)11-1-5-13(6-2-11)26-10-16(22)23/h1-8,15,20-21H,9-10H2,(H3,18,19)(H,22,23)