2-[4-(2-butoxyethoxy)phenyl]-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid

Systemtic Name: 2-[4-(2-butoxyethoxy)phenyl]-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid Openeye Name: 2-[4-(2-butoxyethoxy)phenyl]-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid CAS Name: 2-[4-(2-butoxyethoxy)phenyl]-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid IUPAC Name: 2-[4-(2-butoxyethoxy)phenyl]-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid Traditional Name: 2-[4-(2-butoxyethoxy)phenyl]-1-(4-sulfamoylphenyl)-2,3-dihydro-1-benzazepine-4-carboxylic acid Formula: C29H32N2O6S MolecularWeight: 536.63918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCOC1=CC=C(C=C1)C2CC(=CC3=CC=CC=C3N2C4=CC=C(C=C4)S(=O)(=O)N)C(=O)O

Isomeric SMILES

CCCCOCCOC1=CC=C(C=C1)C2CC(=CC3=CC=CC=C3N2C4=CC=C(C=C4)S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C29H32N2O6S/c1-2-3-16-36-17-18-37-25-12-8-21(9-13-25)28-20-23(29(32)33)19-22-6-4-5-7-27(22)31(28)24-10-14-26(15-11-24)38(30,34)35/h4-15,19,28H,2-3,16-18,20H2,1H3,(H,32,33)(H2,30,34,35)