3-[4-(cyclohexylcarbonylamino)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 3-[4-(cyclohexylcarbonylamino)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-(cyclohexanecarbonylamino)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-[[cyclohexyl(oxo)methyl]amino]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-(cyclohexanecarbonylamino)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-(cyclohexanecarbonylamino)piperidino]sulfonylbenzoic acid Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C19H26N2O5S/c22-18(14-5-2-1-3-6-14)20-16-9-11-21(12-10-16)27(25,26)17-8-4-7-15(13-17)19(23)24/h4,7-8,13-14,16H,1-3,5-6,9-12H2,(H,20,22)(H,23,24)