3-(dipropylcarbamoyl)-5-[methyl(phenylsulfonyl)amino]benzoic acid

Systemtic Name: 3-(dipropylcarbamoyl)-5-[methyl(phenylsulfonyl)amino]benzoic acid Openeye Name: 3-[benzenesulfonyl(methyl)amino]-5-(dipropylcarbamoyl)benzoic acid CAS Name: 3-[benzenesulfonyl(methyl)amino]-5-[(dipropylamino)-oxomethyl]benzoic acid IUPAC Name: 3-[benzenesulfonyl(methyl)amino]-5-(dipropylcarbamoyl)benzoic acid Traditional Name: 3-[besyl(methyl)amino]-5-(dipropylcarbamoyl)benzoic acid Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)N(C)S(=O)(=O)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)N(C)S(=O)(=O)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H26N2O5S/c1-4-11-23(12-5-2)20(24)16-13-17(21(25)26)15-18(14-16)22(3)29(27,28)19-9-7-6-8-10-19/h6-10,13-15H,4-5,11-12H2,1-3H3,(H,25,26)