6,9-dimethoxy-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine

Systemtic Name: 6,9-dimethoxy-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Openeye Name: 6,9-dimethoxy-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine CAS Name: 6,9-dimethoxy-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine IUPAC Name: 6,9-dimethoxy-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Traditional Name: 6,9-dimethoxy-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Formula: C18H20N2O6S MolecularWeight: 392.4262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CCCCN(C2=C(C=C1)OC)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C2CCCCN(C2=C(C=C1)OC)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O6S/c1-25-16-9-10-17(26-2)18-15(16)8-3-4-11-19(18)27(23,24)14-7-5-6-13(12-14)20(21)22/h5-7,9-10,12H,3-4,8,11H2,1-2H3