3-[(1E,3Z)-3-methylpenta-1,3-dienyl]-1-(4-methylphenyl)sulfonyl-indole

Systemtic Name: 3-[(1E,3Z)-3-methylpenta-1,3-dienyl]-1-(4-methylphenyl)sulfonyl-indole Openeye Name: 3-[(1E,3Z)-3-methylpenta-1,3-dienyl]-1-(p-tolylsulfonyl)indole CAS Name: 3-[(1E,3Z)-3-methylpenta-1,3-dienyl]-1-(4-methylphenyl)sulfonylindole IUPAC Name: 3-[(1E,3Z)-3-methylpenta-1,3-dienyl]-1-(4-methylphenyl)sulfonylindole Traditional Name: 3-[(1E,3Z)-3-methylpenta-1,3-dienyl]-1-tosyl-indole Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C=CC1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

C/C=C(/C)\C=C\C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H21NO2S/c1-4-16(2)9-12-18-15-22(21-8-6-5-7-20(18)21)25(23,24)19-13-10-17(3)11-14-19/h4-15H,1-3H3/b12-9+,16-4-