4-[butyl-(2-carboxyphenyl)sulfonyl-amino]benzoate

Systemtic Name: 4-[butyl-(2-carboxyphenyl)sulfonyl-amino]benzoate Openeye Name: 4-[butyl-(2-carboxyphenyl)sulfonyl-amino]benzoate CAS Name: 4-[butyl-(2-carboxyphenyl)sulfonylamino]benzoate IUPAC Name: 4-[butyl-(2-carboxyphenyl)sulfonylamino]benzoate Traditional Name: 4-[butyl-(2-carboxyphenyl)sulfonyl-amino]benzoate Formula: C18H18NO6S- MolecularWeight: 376.40362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(C=C1)C(=O)[O-])S(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCN(C1=CC=C(C=C1)C(=O)[O-])S(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H19NO6S/c1-2-3-12-19(14-10-8-13(9-11-14)17(20)21)26(24,25)16-7-5-4-6-15(16)18(22)23/h4-11H,2-3,12H2,1H3,(H,20,21)(H,22,23)/p-1