(2-methyl-1-oxidanyl-propyl) 4-(cyclohexylmethyl)-8-methyl-quinoline-2-carboxylate

Systemtic Name: (2-methyl-1-oxidanyl-propyl) 4-(cyclohexylmethyl)-8-methyl-quinoline-2-carboxylate Openeye Name: (1-hydroxy-2-methyl-propyl) 4-(cyclohexylmethyl)-8-methyl-quinoline-2-carboxylate CAS Name: 4-(cyclohexylmethyl)-8-methyl-2-quinolinecarboxylic acid (1-hydroxy-2-methylpropyl) ester IUPAC Name: (1-hydroxy-2-methylpropyl) 4-(cyclohexylmethyl)-8-methylquinoline-2-carboxylate Traditional Name: 4-(cyclohexylmethyl)-8-methyl-quinaldic acid (1-hydroxy-2-methyl-propyl) ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2CC3CCCCC3)C(=O)OC(C(C)C)O

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2CC3CCCCC3)C(=O)OC(C(C)C)O

InChI

InChI=1S/C22H29NO3/c1-14(2)21(24)26-22(25)19-13-17(12-16-9-5-4-6-10-16)18-11-7-8-15(3)20(18)23-19/h7-8,11,13-14,16,21,24H,4-6,9-10,12H2,1-3H3