tert-butyl (3R)-7-bromanyl-8-methoxy-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylate

Systemtic Name: tert-butyl (3R)-7-bromanyl-8-methoxy-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylate Openeye Name: tert-butyl (3R)-7-bromo-8-methoxy-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylate CAS Name: (3R)-7-bromo-8-methoxy-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-7-bromo-8-methoxy-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylate Traditional Name: (3R)-7-bromo-2-keto-8-methoxy-1,3,4,5-tetrahydro-1-benzazepine-3-carboxylic acid tert-butyl ester Formula: C16H20BrNO4 MolecularWeight: 370.2383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC2=CC(=C(C=C2NC1=O)OC)Br

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1CCC2=CC(=C(C=C2NC1=O)OC)Br

InChI

InChI=1S/C16H20BrNO4/c1-16(2,3)22-15(20)10-6-5-9-7-11(17)13(21-4)8-12(9)18-14(10)19/h7-8,10H,5-6H2,1-4H3,(H,18,19)/t10-/m1/s1