3-[cyclohexyl(oxidanyl)methyl]-8-methyl-quinoline-2-carboxylic acid

Systemtic Name: 3-[cyclohexyl(oxidanyl)methyl]-8-methyl-quinoline-2-carboxylic acid Openeye Name: 3-[cyclohexyl(hydroxy)methyl]-8-methyl-quinoline-2-carboxylic acid CAS Name: 3-[cyclohexyl(hydroxy)methyl]-8-methyl-2-quinolinecarboxylic acid IUPAC Name: 3-[cyclohexyl(hydroxy)methyl]-8-methylquinoline-2-carboxylic acid Traditional Name: 3-[cyclohexyl(hydroxy)methyl]-8-methyl-quinaldic acid Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)C(=O)O)C(C3CCCCC3)O

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)C(=O)O)C(C3CCCCC3)O

InChI

InChI=1S/C18H21NO3/c1-11-6-5-9-13-10-14(16(18(21)22)19-15(11)13)17(20)12-7-3-2-4-8-12/h5-6,9-10,12,17,20H,2-4,7-8H2,1H3,(H,21,22)