2-[methyl-(3-piperidin-1-ylsulfonylphenyl)carbonyl-amino]benzoic acid

Systemtic Name: 2-[methyl-(3-piperidin-1-ylsulfonylphenyl)carbonyl-amino]benzoic acid Openeye Name: 2-[methyl-[3-(1-piperidylsulfonyl)benzoyl]amino]benzoic acid CAS Name: 2-[methyl-[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]benzoic acid IUPAC Name: 2-[methyl-(3-piperidin-1-ylsulfonylbenzoyl)amino]benzoic acid Traditional Name: 2-[methyl-(3-piperidinosulfonylbenzoyl)amino]benzoic acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)O)C(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H22N2O5S/c1-21(18-11-4-3-10-17(18)20(24)25)19(23)15-8-7-9-16(14-15)28(26,27)22-12-5-2-6-13-22/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,24,25)