methyl 4-[(4-fluorophenyl)amino]-6-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 4-[(4-fluorophenyl)amino]-6-(4-methoxyphenyl)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 4-(4-fluoroanilino)-6-(4-methoxyphenyl)-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-(4-fluoroanilino)-6-(4-methoxyphenyl)-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluoroanilino)-6-(4-methoxyphenyl)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 4-(4-fluoroanilino)-2-keto-6-(4-methoxyphenyl)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C21H20FNO4 MolecularWeight: 369.386203

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=CC(=O)C2C(=O)OC)NC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=C(C=C1)C2CC(=CC(=O)C2C(=O)OC)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FNO4/c1-26-17-9-3-13(4-10-17)18-11-16(12-19(24)20(18)21(25)27-2)23-15-7-5-14(22)6-8-15/h3-10,12,18,20,23H,11H2,1-2H3