(2-bromophenyl) 2,3,4,5-tetrahydro-1H-2-benzazepine-8-sulfonate

Systemtic Name: (2-bromophenyl) 2,3,4,5-tetrahydro-1H-2-benzazepine-8-sulfonate Openeye Name: (2-bromophenyl) 2,3,4,5-tetrahydro-1H-2-benzazepine-8-sulfonate CAS Name: 2,3,4,5-tetrahydro-1H-2-benzazepine-8-sulfonic acid (2-bromophenyl) ester IUPAC Name: (2-bromophenyl) 2,3,4,5-tetrahydro-1H-2-benzazepine-8-sulfonate Traditional Name: 2,3,4,5-tetrahydro-1H-2-benzazepine-8-sulfonic acid (2-bromophenyl) ester Formula: C16H16BrNO3S MolecularWeight: 382.27214

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CNC1)C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3Br

Isomeric SMILES

C1CC2=C(CNC1)C=C(C=C2)S(=O)(=O)OC3=CC=CC=C3Br

InChI

InChI=1S/C16H16BrNO3S/c17-15-5-1-2-6-16(15)21-22(19,20)14-8-7-12-4-3-9-18-11-13(12)10-14/h1-2,5-8,10,18H,3-4,9,11H2