1-[(7aS)-2-(4-methylphenyl)sulfonyl-6-phenyl-1,3,7,7a-tetrahydroisoindol-5-yl]ethanone

Systemtic Name: 1-[(7aS)-2-(4-methylphenyl)sulfonyl-6-phenyl-1,3,7,7a-tetrahydroisoindol-5-yl]ethanone Openeye Name: 1-[(7aS)-6-phenyl-2-(p-tolylsulfonyl)-1,3,7,7a-tetrahydroisoindol-5-yl]ethanone CAS Name: 1-[(7aS)-2-(4-methylphenyl)sulfonyl-6-phenyl-1,3,7,7a-tetrahydroisoindol-5-yl]ethanone IUPAC Name: 1-[(7aS)-2-(4-methylphenyl)sulfonyl-6-phenyl-1,3,7,7a-tetrahydroisoindol-5-yl]ethanone Traditional Name: 1-[(7aS)-6-phenyl-2-tosyl-1,3,7,7a-tetrahydroisoindol-5-yl]ethanone Formula: C23H23NO3S MolecularWeight: 393.49862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3CC(=C(C=C3C2)C(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@H]3CC(=C(C=C3C2)C(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C23H23NO3S/c1-16-8-10-21(11-9-16)28(26,27)24-14-19-12-22(17(2)25)23(13-20(19)15-24)18-6-4-3-5-7-18/h3-12,20H,13-15H2,1-2H3/t20-/m1/s1