4-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamoyl]benzoic acid

Systemtic Name: 4-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamoyl]benzoic acid Openeye Name: 4-[[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]carbamoyl]benzoic acid CAS Name: 4-[[4-[(4-methyl-1-piperidinyl)sulfonyl]anilino]-oxomethyl]benzoic acid IUPAC Name: 4-[[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbamoyl]benzoic acid Traditional Name: 4-[[4-(4-methylpiperidino)sulfonylphenyl]carbamoyl]benzoic acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H22N2O5S/c1-14-10-12-22(13-11-14)28(26,27)18-8-6-17(7-9-18)21-19(23)15-2-4-16(5-3-15)20(24)25/h2-9,14H,10-13H2,1H3,(H,21,23)(H,24,25)