methyl 6-chloranyl-3-ethyl-4-(4-methoxyphenyl)-2-oxidanylidene-4,5-dihydro-1H-1-benzazepine-3-carboxylate

Systemtic Name: methyl 6-chloranyl-3-ethyl-4-(4-methoxyphenyl)-2-oxidanylidene-4,5-dihydro-1H-1-benzazepine-3-carboxylate Openeye Name: methyl 6-chloro-3-ethyl-4-(4-methoxyphenyl)-2-oxo-4,5-dihydro-1H-1-benzazepine-3-carboxylate CAS Name: 6-chloro-3-ethyl-4-(4-methoxyphenyl)-2-oxo-4,5-dihydro-1H-1-benzazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-chloro-3-ethyl-4-(4-methoxyphenyl)-2-oxo-4,5-dihydro-1H-1-benzazepine-3-carboxylate Traditional Name: 6-chloro-3-ethyl-2-keto-4-(4-methoxyphenyl)-4,5-dihydro-1H-1-benzazepine-3-carboxylic acid methyl ester Formula: C21H22ClNO4 MolecularWeight: 387.85668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(CC2=C(C=CC=C2Cl)NC1=O)C3=CC=C(C=C3)OC)C(=O)OC

Isomeric SMILES

CCC1(C(CC2=C(C=CC=C2Cl)NC1=O)C3=CC=C(C=C3)OC)C(=O)OC

InChI

InChI=1S/C21H22ClNO4/c1-4-21(20(25)27-3)16(13-8-10-14(26-2)11-9-13)12-15-17(22)6-5-7-18(15)23-19(21)24/h5-11,16H,4,12H2,1-3H3,(H,23,24)