1-[4-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-en-1-one

Systemtic Name: 1-[4-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-en-1-one Openeye Name: 1-[4-(1-methyleneallyl)-1-(p-tolylsulfonyl)indol-3-yl]prop-2-en-1-one CAS Name: 1-[4-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonyl-3-indolyl]-2-propen-1-one IUPAC Name: 1-[4-buta-1,3-dien-2-yl-1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-en-1-one Traditional Name: 1-[4-(1-methyleneallyl)-1-tosyl-indol-3-yl]prop-2-en-1-one Formula: C22H19NO3S MolecularWeight: 377.45616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)C(=C)C=C)C(=O)C=C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)C(=C)C=C)C(=O)C=C

InChI

InChI=1S/C22H19NO3S/c1-5-16(4)18-8-7-9-20-22(18)19(21(24)6-2)14-23(20)27(25,26)17-12-10-15(3)11-13-17/h5-14H,1-2,4H2,3H3