1-(3-nitrophenyl)sulfonyl-8-phenyl-2,3,4,5-tetrahydro-1-benzazepine

Systemtic Name: 1-(3-nitrophenyl)sulfonyl-8-phenyl-2,3,4,5-tetrahydro-1-benzazepine Openeye Name: 1-(3-nitrophenyl)sulfonyl-8-phenyl-2,3,4,5-tetrahydro-1-benzazepine CAS Name: 1-(3-nitrophenyl)sulfonyl-8-phenyl-2,3,4,5-tetrahydro-1-benzazepine IUPAC Name: 1-(3-nitrophenyl)sulfonyl-8-phenyl-2,3,4,5-tetrahydro-1-benzazepine Traditional Name: 1-(3-nitrophenyl)sulfonyl-8-phenyl-2,3,4,5-tetrahydro-1-benzazepine Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=C(C1)C=CC(=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C2=C(C1)C=CC(=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O4S/c25-24(26)20-10-6-11-21(16-20)29(27,28)23-14-5-4-9-18-12-13-19(15-22(18)23)17-7-2-1-3-8-17/h1-3,6-8,10-13,15-16H,4-5,9,14H2