6,8-dimethyl-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine

Systemtic Name: 6,8-dimethyl-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Openeye Name: 6,8-dimethyl-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine CAS Name: 6,8-dimethyl-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine IUPAC Name: 6,8-dimethyl-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Traditional Name: 6,8-dimethyl-1-(3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2CCCCN(C2=C1)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C2CCCCN(C2=C1)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N2O4S/c1-13-10-14(2)17-8-3-4-9-19(18(17)11-13)25(23,24)16-7-5-6-15(12-16)20(21)22/h5-7,10-12H,3-4,8-9H2,1-2H3