4-(4-methylphenyl)sulfonyl-2-(phenylsulfonyl)-7-propyl-4-azabicyclo[4.2.0]octa-1,6-diene

Systemtic Name: 4-(4-methylphenyl)sulfonyl-2-(phenylsulfonyl)-7-propyl-4-azabicyclo[4.2.0]octa-1,6-diene Openeye Name: 2-(benzenesulfonyl)-7-propyl-4-(p-tolylsulfonyl)-4-azabicyclo[4.2.0]octa-1,6-diene CAS Name: 2-(benzenesulfonyl)-4-(4-methylphenyl)sulfonyl-7-propyl-4-azabicyclo[4.2.0]octa-1,6-diene IUPAC Name: 2-(benzenesulfonyl)-4-(4-methylphenyl)sulfonyl-7-propyl-4-azabicyclo[4.2.0]octa-1,6-diene Traditional Name: 2-besyl-7-propyl-4-tosyl-4-azabicyclo[4.2.0]octa-1,6-diene Formula: C23H25NO4S2 MolecularWeight: 443.5789

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2CN(CC(=C2C1)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCC1=C2CN(CC(=C2C1)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H25NO4S2/c1-3-7-18-14-21-22(18)15-24(30(27,28)20-12-10-17(2)11-13-20)16-23(21)29(25,26)19-8-5-4-6-9-19/h4-6,8-13H,3,7,14-16H2,1-2H3