methyl 4-(4-methoxyphenyl)-2-oxidanylidene-3-prop-2-enyl-7-(trifluoromethyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylate

Systemtic Name: methyl 4-(4-methoxyphenyl)-2-oxidanylidene-3-prop-2-enyl-7-(trifluoromethyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylate Openeye Name: methyl 3-allyl-4-(4-methoxyphenyl)-2-oxo-7-(trifluoromethyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-oxo-3-prop-2-enyl-7-(trifluoromethyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-methoxyphenyl)-2-oxo-3-prop-2-enyl-7-(trifluoromethyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylate Traditional Name: 3-allyl-2-keto-4-(4-methoxyphenyl)-7-(trifluoromethyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylic acid methyl ester Formula: C23H22F3NO4 MolecularWeight: 433.42029

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC3=C(C=CC(=C3)C(F)(F)F)NC(=O)C2(CC=C)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2CC3=C(C=CC(=C3)C(F)(F)F)NC(=O)C2(CC=C)C(=O)OC

InChI

InChI=1S/C23H22F3NO4/c1-4-11-22(21(29)31-3)18(14-5-8-17(30-2)9-6-14)13-15-12-16(23(24,25)26)7-10-19(15)27-20(22)28/h4-10,12,18H,1,11,13H2,2-3H3,(H,27,28)