3-[(2-methoxy-5-piperidin-1-ylcarbonyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 3-[(2-methoxy-5-piperidin-1-ylcarbonyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 3-[[2-methoxy-5-(piperidine-1-carbonyl)phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[2-methoxy-5-[oxo(1-piperidinyl)methyl]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[2-methoxy-5-(piperidine-1-carbonyl)phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[2-methoxy-5-(piperidine-1-carbonyl)phenyl]sulfonylamino]benzoic acid Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCCCC2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCCCC2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H22N2O6S/c1-28-17-9-8-14(19(23)22-10-3-2-4-11-22)13-18(17)29(26,27)21-16-7-5-6-15(12-16)20(24)25/h5-9,12-13,21H,2-4,10-11H2,1H3,(H,24,25)