3-[(1-ethylsulfonylpiperidin-4-yl)carbonylamino]benzoic acid

Systemtic Name: 3-[(1-ethylsulfonylpiperidin-4-yl)carbonylamino]benzoic acid Openeye Name: 3-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]benzoic acid CAS Name: 3-[[(1-ethylsulfonyl-4-piperidinyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(1-ethylsulfonylpiperidine-4-carbonyl)amino]benzoic acid Traditional Name: 3-[(1-esylisonipecotoyl)amino]benzoic acid Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H20N2O5S/c1-2-23(21,22)17-8-6-11(7-9-17)14(18)16-13-5-3-4-12(10-13)15(19)20/h3-5,10-11H,2,6-9H2,1H3,(H,16,18)(H,19,20)