2-[4-(cyclohexylcarbamoylamino)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 2-[4-(cyclohexylcarbamoylamino)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 2-[[4-(cyclohexylcarbamoylamino)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 2-[[4-[[(cyclohexylamino)-oxomethyl]amino]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 2-[4-(cyclohexylcarbamoylamino)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 2-[4-(cyclohexylcarbamoylamino)piperidino]sulfonylbenzoic acid Formula: C19H27N3O5S MolecularWeight: 409.49978

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C19H27N3O5S/c23-18(24)16-8-4-5-9-17(16)28(26,27)22-12-10-15(11-13-22)21-19(25)20-14-6-2-1-3-7-14/h4-5,8-9,14-15H,1-3,6-7,10-13H2,(H,23,24)(H2,20,21,25)