(phenylmethyl) 5-methyl-2-[(E)-1-(4-methylphenyl)sulfonylprop-1-en-2-yl]-2,3-dihydroindole-1-carboxylate

Systemtic Name: (phenylmethyl) 5-methyl-2-[(E)-1-(4-methylphenyl)sulfonylprop-1-en-2-yl]-2,3-dihydroindole-1-carboxylate Openeye Name: benzyl 5-methyl-2-[(E)-1-methyl-2-(p-tolylsulfonyl)vinyl]indoline-1-carboxylate CAS Name: 5-methyl-2-[(E)-1-(4-methylphenyl)sulfonylprop-1-en-2-yl]-2,3-dihydroindole-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-2-[(E)-1-(4-methylphenyl)sulfonylprop-1-en-2-yl]-2,3-dihydroindole-1-carboxylate Traditional Name: 5-methyl-2-[(E)-1-methyl-2-tosyl-vinyl]indoline-1-carboxylic acid benzyl ester Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C=C(C)C2CC3=C(N2C(=O)OCC4=CC=CC=C4)C=CC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C=C(\C)/C2CC3=C(N2C(=O)OCC4=CC=CC=C4)C=CC(=C3)C

InChI

InChI=1S/C27H27NO4S/c1-19-9-12-24(13-10-19)33(30,31)18-21(3)26-16-23-15-20(2)11-14-25(23)28(26)27(29)32-17-22-7-5-4-6-8-22/h4-15,18,26H,16-17H2,1-3H3/b21-18+