dimethyl 1-cyclohexyl-2-phenyl-5-(phenylcarbonyl)-2,3-dihydropyrrole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-cyclohexyl-2-phenyl-5-(phenylcarbonyl)-2,3-dihydropyrrole-3,4-dicarboxylate Openeye Name: dimethyl 5-benzoyl-1-cyclohexyl-2-phenyl-2,3-dihydropyrrole-3,4-dicarboxylate CAS Name: 5-benzoyl-1-cyclohexyl-2-phenyl-2,3-dihydropyrrole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-benzoyl-1-cyclohexyl-2-phenyl-2,3-dihydropyrrole-3,4-dicarboxylate Traditional Name: 2-benzoyl-1-cyclohexyl-5-phenyl-2-pyrroline-3,4-dicarboxylic acid dimethyl ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(N(C(=C1C(=O)OC)C(=O)C2=CC=CC=C2)C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1C(N(C(=C1C(=O)OC)C(=O)C2=CC=CC=C2)C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C27H29NO5/c1-32-26(30)21-22(27(31)33-2)24(25(29)19-14-8-4-9-15-19)28(20-16-10-5-11-17-20)23(21)18-12-6-3-7-13-18/h3-4,6-9,12-15,20-21,23H,5,10-11,16-17H2,1-2H3