methyl (2S,3R)-3-cyano-1-methyl-5-(4-nitrophenyl)-2,4-diphenyl-2H-pyrrole-3-carboxylate

Systemtic Name: methyl (2S,3R)-3-cyano-1-methyl-5-(4-nitrophenyl)-2,4-diphenyl-2H-pyrrole-3-carboxylate Openeye Name: methyl (2S,3R)-3-cyano-1-methyl-5-(4-nitrophenyl)-2,4-diphenyl-2H-pyrrole-3-carboxylate CAS Name: (2S,3R)-3-cyano-1-methyl-5-(4-nitrophenyl)-2,4-diphenyl-2H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl (2S,3R)-3-cyano-1-methyl-5-(4-nitrophenyl)-2,4-diphenyl-2H-pyrrole-3-carboxylate Traditional Name: (2S,3R)-3-cyano-1-methyl-5-(4-nitrophenyl)-2,4-diphenyl-2-pyrroline-3-carboxylic acid methyl ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)(C#N)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CN1[C@H]([C@](C(=C1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3)(C#N)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O4/c1-28-23(19-13-15-21(16-14-19)29(31)32)22(18-9-5-3-6-10-18)26(17-27,25(30)33-2)24(28)20-11-7-4-8-12-20/h3-16,24H,1-2H3/t24-,26+/m0/s1