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

Systemtic Name: methyl 1-(methoxymethyl)-4-(2-methoxyphenyl)-2-oxidanylidene-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepine-3-carboxylate Openeye Name: methyl 1-(methoxymethyl)-4-(2-methoxyphenyl)-2-oxo-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepine-3-carboxylate CAS Name: 1-(methoxymethyl)-4-(2-methoxyphenyl)-2-oxo-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 1-(methoxymethyl)-4-(2-methoxyphenyl)-2-oxo-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepine-3-carboxylate Traditional Name: 2-keto-1-(methoxymethyl)-4-(2-methoxyphenyl)-7-(trifluoromethyl)-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid methyl ester Formula: C22H22F3NO5 MolecularWeight: 437.40899

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Descriptors Computed from Structure

Canonical SMILES:

COCN1C2=C(CC(C(C1=O)C(=O)OC)C3=CC=CC=C3OC)C=C(C=C2)C(F)(F)F

Isomeric SMILES

COCN1C2=C(CC(C(C1=O)C(=O)OC)C3=CC=CC=C3OC)C=C(C=C2)C(F)(F)F

InChI

InChI=1S/C22H22F3NO5/c1-29-12-26-17-9-8-14(22(23,24)25)10-13(17)11-16(19(20(26)27)21(28)31-3)15-6-4-5-7-18(15)30-2/h4-10,16,19H,11-12H2,1-3H3