2-methoxyethyl 2-[(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)-[(4-methylpyridin-3-yl)methyl]carbamoyl]cyclohexene-1-carboxylate

Systemtic Name: 2-methoxyethyl 2-[(4-chloranyl-2-fluoranyl-5-propan-2-yloxy-phenyl)-[(4-methylpyridin-3-yl)methyl]carbamoyl]cyclohexene-1-carboxylate Openeye Name: 2-methoxyethyl 2-[(4-chloro-2-fluoro-5-isopropoxy-phenyl)-[(4-methyl-3-pyridyl)methyl]carbamoyl]cyclohexene-1-carboxylate CAS Name: 2-[[4-chloro-2-fluoro-N-[(4-methyl-3-pyridinyl)methyl]-5-propan-2-yloxyanilino]-oxomethyl]-1-cyclohexenecarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-[(4-chloro-2-fluoro-5-propan-2-yloxyphenyl)-[(4-methylpyridin-3-yl)methyl]carbamoyl]cyclohexene-1-carboxylate Traditional Name: 2-[(4-chloro-2-fluoro-5-isopropoxy-phenyl)-[(4-methyl-3-pyridyl)methyl]carbamoyl]cyclohexene-1-carboxylic acid 2-methoxyethyl ester Formula: C27H32ClFN2O5 MolecularWeight: 519.004783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC=C1)CN(C2=CC(=C(C=C2F)Cl)OC(C)C)C(=O)C3=C(CCCC3)C(=O)OCCOC

Isomeric SMILES

CC1=C(C=NC=C1)CN(C2=CC(=C(C=C2F)Cl)OC(C)C)C(=O)C3=C(CCCC3)C(=O)OCCOC

InChI

InChI=1S/C27H32ClFN2O5/c1-17(2)36-25-14-24(23(29)13-22(25)28)31(16-19-15-30-10-9-18(19)3)26(32)20-7-5-6-8-21(20)27(33)35-12-11-34-4/h9-10,13-15,17H,5-8,11-12,16H2,1-4H3