tert-butyl 1-ethyl-8-methoxy-2-oxidanylidene-7-phenyl-4,5-dihydro-3H-1-benzazepine-3-carboxylate

Systemtic Name: tert-butyl 1-ethyl-8-methoxy-2-oxidanylidene-7-phenyl-4,5-dihydro-3H-1-benzazepine-3-carboxylate Openeye Name: tert-butyl 1-ethyl-8-methoxy-2-oxo-7-phenyl-4,5-dihydro-3H-1-benzazepine-3-carboxylate CAS Name: 1-ethyl-8-methoxy-2-oxo-7-phenyl-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-ethyl-8-methoxy-2-oxo-7-phenyl-4,5-dihydro-3H-1-benzazepine-3-carboxylate Traditional Name: 1-ethyl-2-keto-8-methoxy-7-phenyl-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid tert-butyl ester Formula: C24H29NO4 MolecularWeight: 395.49136

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CCC(C1=O)C(=O)OC(C)(C)C)C=C(C(=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(CCC(C1=O)C(=O)OC(C)(C)C)C=C(C(=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C24H29NO4/c1-6-25-20-15-21(28-5)19(16-10-8-7-9-11-16)14-17(20)12-13-18(22(25)26)23(27)29-24(2,3)4/h7-11,14-15,18H,6,12-13H2,1-5H3