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

Systemtic Name: ethyl 4-[1-[4-methyl-1-(4-methylphenyl)sulfonyl-2,5-dihydropyrrol-3-yl]ethenyl]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C(=C)C2=C(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C(=C)C2=C(CN(C2)S(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C23H25NO4S/c1-5-28-23(25)20-10-8-19(9-11-20)18(4)22-15-24(14-17(22)3)29(26,27)21-12-6-16(2)7-13-21/h6-13H,4-5,14-15H2,1-3H3