4-(3-carbamimidoylphenoxy)-2-sulfamoyl-butanoic acid

Systemtic Name: 4-(3-carbamimidoylphenoxy)-2-sulfamoyl-butanoic acid Openeye Name: 4-(3-carbamimidoylphenoxy)-2-sulfamoyl-butanoic acid CAS Name: 4-(3-carbamimidoylphenoxy)-2-sulfamoylbutanoic acid IUPAC Name: 4-(3-carbamimidoylphenoxy)-2-sulfamoylbutanoic acid Traditional Name: 4-(3-amidinophenoxy)-2-sulfamoyl-butyric acid Formula: C11H15N3O5S MolecularWeight: 301.3189

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCC(C(=O)O)S(=O)(=O)N)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)OCCC(C(=O)O)S(=O)(=O)N)C(=N)N

InChI

InChI=1S/C11H15N3O5S/c12-10(13)7-2-1-3-8(6-7)19-5-4-9(11(15)16)20(14,17)18/h1-3,6,9H,4-5H2,(H3,12,13)(H,15,16)(H2,14,17,18)