(E)-3-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]prop-2-enoic acid CAS Name: (E)-3-[1-(2,4,6-trimethylphenyl)sulfonyl-3-indolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-(2,4,6-trimethylphenyl)sulfonylindol-3-yl]prop-2-enoic acid Traditional Name: (E)-3-(1-mesitylsulfonylindol-3-yl)acrylic acid Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO4S/c1-13-10-14(2)20(15(3)11-13)26(24,25)21-12-16(8-9-19(22)23)17-6-4-5-7-18(17)21/h4-12H,1-3H3,(H,22,23)/b9-8+