methyl (Z)-2-acetamido-3-[4-methyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-enoate

Systemtic Name: methyl (Z)-2-acetamido-3-[4-methyl-1-(4-methylphenyl)sulfonyl-indol-3-yl]prop-2-enoate Openeye Name: methyl (Z)-2-acetamido-3-[4-methyl-1-(p-tolylsulfonyl)indol-3-yl]prop-2-enoate CAS Name: (Z)-2-acetamido-3-[4-methyl-1-(4-methylphenyl)sulfonyl-3-indolyl]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-2-acetamido-3-[4-methyl-1-(4-methylphenyl)sulfonylindol-3-yl]prop-2-enoate Traditional Name: (Z)-2-acetamido-3-(4-methyl-1-tosyl-indol-3-yl)acrylic acid methyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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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(=O)OC)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C(C=CC=C32)C)/C=C(/C(=O)OC)\NC(=O)C

InChI

InChI=1S/C22H22N2O5S/c1-14-8-10-18(11-9-14)30(27,28)24-13-17(21-15(2)6-5-7-20(21)24)12-19(22(26)29-4)23-16(3)25/h5-13H,1-4H3,(H,23,25)/b19-12-