methyl 2-(4-methylphenyl)sulfonyl-6-phenyl-1,3-dihydroisoindole-5-carboxylate

Systemtic Name: methyl 2-(4-methylphenyl)sulfonyl-6-phenyl-1,3-dihydroisoindole-5-carboxylate Openeye Name: methyl 6-phenyl-2-(p-tolylsulfonyl)isoindoline-5-carboxylate CAS Name: 2-(4-methylphenyl)sulfonyl-6-phenyl-1,3-dihydroisoindole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-(4-methylphenyl)sulfonyl-6-phenyl-1,3-dihydroisoindole-5-carboxylate Traditional Name: 6-phenyl-2-tosyl-isoindoline-5-carboxylic acid methyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C2)C=C(C(=C3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C2)C=C(C(=C3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C23H21NO4S/c1-16-8-10-20(11-9-16)29(26,27)24-14-18-12-21(17-6-4-3-5-7-17)22(23(25)28-2)13-19(18)15-24/h3-13H,14-15H2,1-2H3