4-[4-(4-carbamimidoylphenyl)phenoxy]butane-1-sulfonic acid

Systemtic Name: 4-[4-(4-carbamimidoylphenyl)phenoxy]butane-1-sulfonic acid Openeye Name: 4-[4-(4-carbamimidoylphenyl)phenoxy]butane-1-sulfonic acid CAS Name: 4-[4-(4-carbamimidoylphenyl)phenoxy]-1-butanesulfonic acid IUPAC Name: 4-[4-(4-carbamimidoylphenyl)phenoxy]butane-1-sulfonic acid Traditional Name: 4-[4-(4-amidinophenyl)phenoxy]butane-1-sulfonic acid Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(C=C2)OCCCCS(=O)(=O)O)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(C=C2)OCCCCS(=O)(=O)O)C(=N)N

InChI

InChI=1S/C17H20N2O4S/c18-17(19)15-5-3-13(4-6-15)14-7-9-16(10-8-14)23-11-1-2-12-24(20,21)22/h3-10H,1-2,11-12H2,(H3,18,19)(H,20,21,22)