(1E)-3-(4-methylphenyl)sulfonyl-1-(phenylmethylidene)-4,5,6,7-tetrahydro-2H-3-benzazonine

Systemtic Name: (1E)-3-(4-methylphenyl)sulfonyl-1-(phenylmethylidene)-4,5,6,7-tetrahydro-2H-3-benzazonine Openeye Name: (1E)-1-benzylidene-3-(p-tolylsulfonyl)-4,5,6,7-tetrahydro-2H-3-benzazonine CAS Name: (1E)-3-(4-methylphenyl)sulfonyl-1-(phenylmethylene)-4,5,6,7-tetrahydro-2H-3-benzazonine IUPAC Name: (1E)-1-benzylidene-3-(4-methylphenyl)sulfonyl-4,5,6,7-tetrahydro-2H-3-benzazonine Traditional Name: (1E)-1-benzal-3-tosyl-4,5,6,7-tetrahydro-2H-3-benzazonine Formula: C26H27NO2S MolecularWeight: 417.56308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC3=CC=CC=C3C(=CC4=CC=CC=C4)C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC3=CC=CC=C3/C(=C\C4=CC=CC=C4)/C2

InChI

InChI=1S/C26H27NO2S/c1-21-14-16-25(17-15-21)30(28,29)27-18-8-7-12-23-11-5-6-13-26(23)24(20-27)19-22-9-3-2-4-10-22/h2-6,9-11,13-17,19H,7-8,12,18,20H2,1H3/b24-19-