(3Z,6Z)-1,5-bis-(4-methylphenyl)sulfonyl-2,8-dihydro-1,5-diazocine

Systemtic Name: (3Z,6Z)-1,5-bis-(4-methylphenyl)sulfonyl-2,8-dihydro-1,5-diazocine Openeye Name: (3Z,6Z)-1,5-bis(p-tolylsulfonyl)-2,8-dihydro-1,5-diazocine CAS Name: (3Z,6Z)-1,5-bis-(4-methylphenyl)sulfonyl-2,8-dihydro-1,5-diazocine IUPAC Name: (3Z,6Z)-1,5-bis-(4-methylphenyl)sulfonyl-2,8-dihydro-1,5-diazocine Traditional Name: (3Z,6Z)-1,5-ditosyl-2,8-dihydro-1,5-diazocine Formula: C20H22N2O4S2 MolecularWeight: 418.52968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC=CN(C=CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C/C=C\N(/C=C\C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N2O4S2/c1-17-5-9-19(10-6-17)27(23,24)21-13-3-15-22(16-4-14-21)28(25,26)20-11-7-18(2)8-12-20/h3-14H,15-16H2,1-2H3/b13-3-,14-4-