5-(4-cyanophenyl)-4-(4-cyanophenyl)carbonyl-1-cyclohexylcarbonyl-3-(3,4-dimethoxyphenyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 5-(4-cyanophenyl)-4-(4-cyanophenyl)carbonyl-1-cyclohexylcarbonyl-3-(3,4-dimethoxyphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(4-cyanobenzoyl)-5-(4-cyanophenyl)-1-(cyclohexanecarbonyl)-3-(3,4-dimethoxyphenyl)pyrrolidine-2-carboxylic acid CAS Name: 5-(4-cyanophenyl)-4-[(4-cyanophenyl)-oxomethyl]-1-[cyclohexyl(oxo)methyl]-3-(3,4-dimethoxyphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(4-cyanobenzoyl)-5-(4-cyanophenyl)-1-(cyclohexanecarbonyl)-3-(3,4-dimethoxyphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-(4-cyanobenzoyl)-5-(4-cyanophenyl)-1-(cyclohexanecarbonyl)-3-(3,4-dimethoxyphenyl)proline Formula: C35H33N3O6 MolecularWeight: 591.65302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)C3CCCCC3)C4=CC=C(C=C4)C#N)C(=O)C5=CC=C(C=C5)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C(C(N(C2C(=O)O)C(=O)C3CCCCC3)C4=CC=C(C=C4)C#N)C(=O)C5=CC=C(C=C5)C#N)OC

InChI

InChI=1S/C35H33N3O6/c1-43-27-17-16-26(18-28(27)44-2)29-30(33(39)24-14-10-22(20-37)11-15-24)31(23-12-8-21(19-36)9-13-23)38(32(29)35(41)42)34(40)25-6-4-3-5-7-25/h8-18,25,29-32H,3-7H2,1-2H3,(H,41,42)