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

Systemtic Name: methyl 4-[(4-fluorophenyl)methylamino]-6-methyl-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 4-[(4-fluorophenyl)methylamino]-6-methyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-[(4-fluorophenyl)methylamino]-6-methyl-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 4-[(4-fluorophenyl)methylamino]-6-methyl-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 4-[(4-fluorobenzyl)amino]-2-keto-6-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C16H18FNO3 MolecularWeight: 291.317423

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC(=O)C1C(=O)OC)NCC2=CC=C(C=C2)F

Isomeric SMILES

CC1CC(=CC(=O)C1C(=O)OC)NCC2=CC=C(C=C2)F

InChI

InChI=1S/C16H18FNO3/c1-10-7-13(8-14(19)15(10)16(20)21-2)18-9-11-3-5-12(17)6-4-11/h3-6,8,10,15,18H,7,9H2,1-2H3