4-[(4-carbamimidoylphenyl)sulfonylamino]-2-phenoxy-butanoic acid

Systemtic Name: 4-[(4-carbamimidoylphenyl)sulfonylamino]-2-phenoxy-butanoic acid Openeye Name: 4-[(4-carbamimidoylphenyl)sulfonylamino]-2-phenoxy-butanoic acid CAS Name: 4-[(4-carbamimidoylphenyl)sulfonylamino]-2-phenoxybutanoic acid IUPAC Name: 4-[(4-carbamimidoylphenyl)sulfonylamino]-2-phenoxybutanoic acid Traditional Name: 4-[(4-amidinophenyl)sulfonylamino]-2-phenoxy-butyric acid Formula: C17H19N3O5S MolecularWeight: 377.41486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(CCNS(=O)(=O)C2=CC=C(C=C2)C(=N)N)C(=O)O

InChI

InChI=1S/C17H19N3O5S/c18-16(19)12-6-8-14(9-7-12)26(23,24)20-11-10-15(17(21)22)25-13-4-2-1-3-5-13/h1-9,15,20H,10-11H2,(H3,18,19)(H,21,22)