7-cyclopropyl-3-(4-methylphenyl)sulfonyl-6-(4-nitrophenyl)-3-azabicyclo[4.1.0]hept-4-ene

Systemtic Name: 7-cyclopropyl-3-(4-methylphenyl)sulfonyl-6-(4-nitrophenyl)-3-azabicyclo[4.1.0]hept-4-ene Openeye Name: 7-cyclopropyl-6-(4-nitrophenyl)-3-(p-tolylsulfonyl)-3-azabicyclo[4.1.0]hept-4-ene CAS Name: 7-cyclopropyl-3-(4-methylphenyl)sulfonyl-6-(4-nitrophenyl)-3-azabicyclo[4.1.0]hept-4-ene IUPAC Name: 7-cyclopropyl-3-(4-methylphenyl)sulfonyl-6-(4-nitrophenyl)-3-azabicyclo[4.1.0]hept-4-ene Traditional Name: 7-cyclopropyl-6-(4-nitrophenyl)-3-tosyl-3-azabicyclo[4.1.0]hept-4-ene Formula: C22H22N2O4S MolecularWeight: 410.48608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3C(C3(C=C2)C4=CC=C(C=C4)[N+](=O)[O-])C5CC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3C(C3(C=C2)C4=CC=C(C=C4)[N+](=O)[O-])C5CC5

InChI

InChI=1S/C22H22N2O4S/c1-15-2-10-19(11-3-15)29(27,28)23-13-12-22(20(14-23)21(22)16-4-5-16)17-6-8-18(9-7-17)24(25)26/h2-3,6-13,16,20-21H,4-5,14H2,1H3