tert-butyl (3R)-1-[(3-fluorophenyl)methyl]-8-methoxy-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylate

Systemtic Name: tert-butyl (3R)-1-[(3-fluorophenyl)methyl]-8-methoxy-2-oxidanylidene-4,5-dihydro-3H-1-benzazepine-3-carboxylate Openeye Name: tert-butyl (3R)-1-[(3-fluorophenyl)methyl]-8-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylate CAS Name: (3R)-1-[(3-fluorophenyl)methyl]-8-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-1-[(3-fluorophenyl)methyl]-8-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepine-3-carboxylate Traditional Name: (3R)-1-(3-fluorobenzyl)-2-keto-8-methoxy-4,5-dihydro-3H-1-benzazepine-3-carboxylic acid tert-butyl ester Formula: C23H26FNO4 MolecularWeight: 399.455243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC2=C(C=C(C=C2)OC)N(C1=O)CC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1CCC2=C(C=C(C=C2)OC)N(C1=O)CC3=CC(=CC=C3)F

InChI

InChI=1S/C23H26FNO4/c1-23(2,3)29-22(27)19-11-9-16-8-10-18(28-4)13-20(16)25(21(19)26)14-15-6-5-7-17(24)12-15/h5-8,10,12-13,19H,9,11,14H2,1-4H3/t19-/m1/s1