1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine

Systemtic Name: 1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Openeye Name: 1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine CAS Name: 1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine IUPAC Name: 1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Traditional Name: 1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Formula: C16H16N2O4S MolecularWeight: 332.37424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4S/c19-18(20)14-8-5-9-15(12-14)23(21,22)17-11-4-3-7-13-6-1-2-10-16(13)17/h1-2,5-6,8-10,12H,3-4,7,11H2