[1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate

Systemtic Name: [1-[(1-cyanocyclohexyl)amino]-1-oxidanylidene-propan-2-yl] 2-(2-chloranyl-6-fluoranyl-phenyl)ethanoate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-1-methyl-2-oxo-ethyl] 2-(2-chloro-6-fluoro-phenyl)acetate CAS Name: 2-(2-chloro-6-fluorophenyl)acetic acid [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(1-cyanocyclohexyl)amino]-1-oxopropan-2-yl] 2-(2-chloro-6-fluorophenyl)acetate Traditional Name: 2-(2-chloro-6-fluoro-phenyl)acetic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H20ClFN2O3 MolecularWeight: 366.814403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CC(C(=O)NC1(CCCCC1)C#N)OC(=O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C18H20ClFN2O3/c1-12(17(24)22-18(11-21)8-3-2-4-9-18)25-16(23)10-13-14(19)6-5-7-15(13)20/h5-7,12H,2-4,8-10H2,1H3,(H,22,24)