[1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 6-chloranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [1-[(2-methylcyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 6-chloranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [1-methyl-2-[(2-methylcyclohexyl)amino]-2-oxo-ethyl] 6-chloro-2-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-3-quinolinecarboxylic acid [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-methylcyclohexyl)amino]-1-oxopropan-2-yl] 6-chloro-2-methylquinoline-3-carboxylate Traditional Name: 6-chloro-2-methyl-quinoline-3-carboxylic acid [2-keto-1-methyl-2-[(2-methylcyclohexyl)amino]ethyl] ester Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(C)OC(=O)C2=C(N=C3C=CC(=CC3=C2)Cl)C

Isomeric SMILES

CC1CCCCC1NC(=O)C(C)OC(=O)C2=C(N=C3C=CC(=CC3=C2)Cl)C

InChI

InChI=1S/C21H25ClN2O3/c1-12-6-4-5-7-18(12)24-20(25)14(3)27-21(26)17-11-15-10-16(22)8-9-19(15)23-13(17)2/h8-12,14,18H,4-7H2,1-3H3,(H,24,25)