methyl 7-bromanyl-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate

Systemtic Name: methyl 7-bromanyl-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate Openeye Name: methyl 7-bromo-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate CAS Name: 7-bromo-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester IUPAC Name: methyl 7-bromo-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylate Traditional Name: 7-bromo-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid methyl ester Formula: C18H17BrN2O4S MolecularWeight: 437.30758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=CC(=C2)Br)N(CC1)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC(=O)C1=CC2=C(C=CC(=C2)Br)N(CC1)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C18H17BrN2O4S/c1-25-18(22)12-8-9-21(17-7-2-14(19)11-13(17)10-12)15-3-5-16(6-4-15)26(20,23)24/h2-7,10-11H,8-9H2,1H3,(H2,20,23,24)