1-[1-(4-methylphenyl)sulfonylindol-3-yl]propan-1-one

Systemtic Name: 1-[1-(4-methylphenyl)sulfonylindol-3-yl]propan-1-one Openeye Name: 1-[1-(p-tolylsulfonyl)indol-3-yl]propan-1-one CAS Name: 1-[1-(4-methylphenyl)sulfonyl-3-indolyl]-1-propanone IUPAC Name: 1-[1-(4-methylphenyl)sulfonylindol-3-yl]propan-1-one Traditional Name: 1-(1-tosylindol-3-yl)propan-1-one Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO3S/c1-3-18(20)16-12-19(17-7-5-4-6-15(16)17)23(21,22)14-10-8-13(2)9-11-14/h4-12H,3H2,1-2H3