ethyl (2S,5S)-5-tert-butyl-1-(4-methylphenyl)sulfonyl-2-naphthalen-1-yl-2,5-dihydropyrrole-3-carboxylate

Systemtic Name: ethyl (2S,5S)-5-tert-butyl-1-(4-methylphenyl)sulfonyl-2-naphthalen-1-yl-2,5-dihydropyrrole-3-carboxylate Openeye Name: ethyl (2S,5S)-5-tert-butyl-2-(1-naphthyl)-1-(p-tolylsulfonyl)-2,5-dihydropyrrole-3-carboxylate CAS Name: (2S,5S)-5-tert-butyl-1-(4-methylphenyl)sulfonyl-2-(1-naphthalenyl)-2,5-dihydropyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (2S,5S)-5-tert-butyl-1-(4-methylphenyl)sulfonyl-2-naphthalen-1-yl-2,5-dihydropyrrole-3-carboxylate Traditional Name: (2S,5S)-5-tert-butyl-2-(1-naphthyl)-1-tosyl-3-pyrroline-3-carboxylic acid ethyl ester Formula: C28H31NO4S MolecularWeight: 477.61504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(N(C1C2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C[C@H](N([C@H]1C2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)C)C(C)(C)C

InChI

InChI=1S/C28H31NO4S/c1-6-33-27(30)24-18-25(28(3,4)5)29(34(31,32)21-16-14-19(2)15-17-21)26(24)23-13-9-11-20-10-7-8-12-22(20)23/h7-18,25-26H,6H2,1-5H3/t25-,26-/m0/s1