[2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl] 7-fluoranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxidanylidene-ethyl] 7-fluoranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxo-ethyl] 7-fluoro-2-methyl-quinoline-3-carboxylate CAS Name: 7-fluoro-2-methyl-3-quinolinecarboxylic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2,3-dimethylcyclohexyl)amino]-2-oxoethyl] 7-fluoro-2-methylquinoline-3-carboxylate Traditional Name: 7-fluoro-2-methyl-quinoline-3-carboxylic acid [2-[(2,3-dimethylcyclohexyl)amino]-2-keto-ethyl] ester Formula: C21H25FN2O3 MolecularWeight: 372.433203

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)COC(=O)C2=C(N=C3C=C(C=CC3=C2)F)C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)COC(=O)C2=C(N=C3C=C(C=CC3=C2)F)C

InChI

InChI=1S/C21H25FN2O3/c1-12-5-4-6-18(13(12)2)24-20(25)11-27-21(26)17-9-15-7-8-16(22)10-19(15)23-14(17)3/h7-10,12-13,18H,4-6,11H2,1-3H3,(H,24,25)