2-cyclohexyl-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-cyclohexyl-6-piperidin-1-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-cyclohexyl-6-(1-piperidylsulfonyl)quinoline-4-carboxylic acid CAS Name: 2-cyclohexyl-6-(1-piperidinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-cyclohexyl-6-piperidin-1-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-cyclohexyl-6-piperidinosulfonyl-cinchoninic acid Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)C(=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)C(=C2)C(=O)O

InChI

InChI=1S/C21H26N2O4S/c24-21(25)18-14-20(15-7-3-1-4-8-15)22-19-10-9-16(13-17(18)19)28(26,27)23-11-5-2-6-12-23/h9-10,13-15H,1-8,11-12H2,(H,24,25)