dimethyl 7-bromanyl-2,3-dihydro-1-benzazepine-1,4-dicarboxylate

Systemtic Name: dimethyl 7-bromanyl-2,3-dihydro-1-benzazepine-1,4-dicarboxylate Openeye Name: dimethyl 7-bromo-2,3-dihydro-1-benzazepine-1,4-dicarboxylate CAS Name: 7-bromo-2,3-dihydro-1-benzazepine-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 7-bromo-2,3-dihydro-1-benzazepine-1,4-dicarboxylate Traditional Name: 7-bromo-2,3-dihydro-1-benzazepine-1,4-dicarboxylic acid dimethyl ester Formula: C14H14BrNO4 MolecularWeight: 340.16926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=CC(=C2)Br)N(CC1)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC2=C(C=CC(=C2)Br)N(CC1)C(=O)OC

InChI

InChI=1S/C14H14BrNO4/c1-19-13(17)9-5-6-16(14(18)20-2)12-4-3-11(15)8-10(12)7-9/h3-4,7-8H,5-6H2,1-2H3