methyl 4-[1-[4-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]ethenyl]benzoate

Systemtic Name: methyl 4-[1-[4-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]ethenyl]benzoate Openeye Name: methyl 4-[1-[4-methyl-1-(p-tolylsulfonyl)-2,5-dihydropyrrol-3-yl]vinyl]benzoate CAS Name: 4-[1-[4-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-[4-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]ethenyl]benzoate Traditional Name: 4-[1-(4-methyl-1-tosyl-3-pyrrolin-3-yl)vinyl]benzoic acid methyl ester Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO4S/c1-15-5-11-20(12-6-15)28(25,26)23-13-16(2)21(14-23)17(3)18-7-9-19(10-8-18)22(24)27-4/h5-12H,3,13-14H2,1-2,4H3