7-butyl-1-(4-methylphenyl)sulfonyl-2,3,3a,6-tetrahydroindole

Systemtic Name: 7-butyl-1-(4-methylphenyl)sulfonyl-2,3,3a,6-tetrahydroindole Openeye Name: 7-butyl-1-(p-tolylsulfonyl)-2,3,3a,6-tetrahydroindole CAS Name: 7-butyl-1-(4-methylphenyl)sulfonyl-2,3,3a,6-tetrahydroindole IUPAC Name: 7-butyl-1-(4-methylphenyl)sulfonyl-2,3,3a,6-tetrahydroindole Traditional Name: 7-butyl-1-tosyl-2,3,3a,6-tetrahydroindole Formula: C19H25NO2S MolecularWeight: 331.4723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(CCN2S(=O)(=O)C3=CC=C(C=C3)C)C=CC1

Isomeric SMILES

CCCCC1=C2C(CCN2S(=O)(=O)C3=CC=C(C=C3)C)C=CC1

InChI

InChI=1S/C19H25NO2S/c1-3-4-6-16-7-5-8-17-13-14-20(19(16)17)23(21,22)18-11-9-15(2)10-12-18/h5,8-12,17H,3-4,6-7,13-14H2,1-2H3