1-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 1-[[4-methyl-3-(1-piperidylsulfonyl)benzoyl]amino]cyclohexanecarboxylic acid CAS Name: 1-[[[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(4-methyl-3-piperidin-1-ylsulfonylbenzoyl)amino]cyclohexane-1-carboxylic acid Traditional Name: 1-[(4-methyl-3-piperidinosulfonyl-benzoyl)amino]cyclohexanecarboxylic acid Formula: C20H28N2O5S MolecularWeight: 408.51172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2(CCCCC2)C(=O)O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2(CCCCC2)C(=O)O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H28N2O5S/c1-15-8-9-16(14-17(15)28(26,27)22-12-6-3-7-13-22)18(23)21-20(19(24)25)10-4-2-5-11-20/h8-9,14H,2-7,10-13H2,1H3,(H,21,23)(H,24,25)