3,4,7-trimethylidene-6-(4-methylphenyl)sulfonyl-1-(phenylmethyl)azocane

Systemtic Name: 3,4,7-trimethylidene-6-(4-methylphenyl)sulfonyl-1-(phenylmethyl)azocane Openeye Name: 1-benzyl-3,4,7-trimethylene-6-(p-tolylsulfonyl)azocane CAS Name: 3,4,7-trimethylene-6-(4-methylphenyl)sulfonyl-1-(phenylmethyl)azocane IUPAC Name: 1-benzyl-3,4,7-trimethylidene-6-(4-methylphenyl)sulfonylazocane Traditional Name: 1-benzyl-3,4,7-trimethylene-6-tosyl-azocane Formula: C24H27NO2S MolecularWeight: 393.54168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2CC(=C)C(=C)CN(CC2=C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2CC(=C)C(=C)CN(CC2=C)CC3=CC=CC=C3

InChI

InChI=1S/C24H27NO2S/c1-18-10-12-23(13-11-18)28(26,27)24-14-19(2)20(3)15-25(16-21(24)4)17-22-8-6-5-7-9-22/h5-13,24H,2-4,14-17H2,1H3