(E)-4-[3-methyl-1-(phenylsulfonyl)indol-2-yl]but-3-en-2-one

Systemtic Name: (E)-4-[3-methyl-1-(phenylsulfonyl)indol-2-yl]but-3-en-2-one Openeye Name: (E)-4-[1-(benzenesulfonyl)-3-methyl-indol-2-yl]but-3-en-2-one CAS Name: (E)-4-[1-(benzenesulfonyl)-3-methyl-2-indolyl]-3-buten-2-one IUPAC Name: (E)-4-[1-(benzenesulfonyl)-3-methylindol-2-yl]but-3-en-2-one Traditional Name: (E)-4-(1-besyl-3-methyl-indol-2-yl)but-3-en-2-one Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3)C=CC(=O)C

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3)/C=C/C(=O)C

InChI

InChI=1S/C19H17NO3S/c1-14(21)12-13-18-15(2)17-10-6-7-11-19(17)20(18)24(22,23)16-8-4-3-5-9-16/h3-13H,1-2H3/b13-12+