(3aR,7aS)-7a-methyl-2-(4-methylphenyl)sulfonyl-3,3a,4,5-tetrahydro-1H-isoindole

Systemtic Name: (3aR,7aS)-7a-methyl-2-(4-methylphenyl)sulfonyl-3,3a,4,5-tetrahydro-1H-isoindole Openeye Name: (3aR,7aS)-7a-methyl-2-(p-tolylsulfonyl)-3,3a,4,5-tetrahydro-1H-isoindole CAS Name: (3aR,7aS)-7a-methyl-2-(4-methylphenyl)sulfonyl-3,3a,4,5-tetrahydro-1H-isoindole IUPAC Name: (3aR,7aS)-7a-methyl-2-(4-methylphenyl)sulfonyl-3,3a,4,5-tetrahydro-1H-isoindole Traditional Name: (3aR,7aS)-7a-methyl-2-tosyl-3,3a,4,5-tetrahydro-1H-isoindole Formula: C16H21NO2S MolecularWeight: 291.40844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3CCC=CC3(C2)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]3CCC=C[C@@]3(C2)C

InChI

InChI=1S/C16H21NO2S/c1-13-6-8-15(9-7-13)20(18,19)17-11-14-5-3-4-10-16(14,2)12-17/h4,6-10,14H,3,5,11-12H2,1-2H3/t14-,16+/m0/s1