trimethyl (2R,5S)-5-(4-chlorophenyl)-1-phenyl-2,5-dihydropyrrole-2,3,4-tricarboxylate

Systemtic Name: trimethyl (2R,5S)-5-(4-chlorophenyl)-1-phenyl-2,5-dihydropyrrole-2,3,4-tricarboxylate Openeye Name: trimethyl (2R,5S)-5-(4-chlorophenyl)-1-phenyl-2,5-dihydropyrrole-2,3,4-tricarboxylate CAS Name: (2R,5S)-5-(4-chlorophenyl)-1-phenyl-2,5-dihydropyrrole-2,3,4-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (2R,5S)-5-(4-chlorophenyl)-1-phenyl-2,5-dihydropyrrole-2,3,4-tricarboxylate Traditional Name: (2R,5S)-5-(4-chlorophenyl)-1-phenyl-3-pyrroline-2,3,4-tricarboxylic acid trimethyl ester Formula: C22H20ClNO6 MolecularWeight: 429.8503

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=C(C(N1C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1C(=C([C@@H](N1C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C(=O)OC)C(=O)OC

InChI

InChI=1S/C22H20ClNO6/c1-28-20(25)16-17(21(26)29-2)19(22(27)30-3)24(15-7-5-4-6-8-15)18(16)13-9-11-14(23)12-10-13/h4-12,18-19H,1-3H3/t18-,19+/m0/s1