4-[4-(3,4-dimethoxyphenyl)-1-(2-methoxyethanoyl)-2-phenyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(3,4-dimethoxyphenyl)-1-(2-methoxyethanoyl)-2-phenyl-5-piperazin-1-ylcarbonyl-pyrrolidin-3-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(3,4-dimethoxyphenyl)-1-(2-methoxyacetyl)-2-phenyl-5-(piperazine-1-carbonyl)pyrrolidine-3-carbonyl]benzonitrile CAS Name: 4-[[4-(3,4-dimethoxyphenyl)-1-(2-methoxy-1-oxoethyl)-5-[oxo(1-piperazinyl)methyl]-2-phenyl-3-pyrrolidinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(3,4-dimethoxyphenyl)-1-(2-methoxyacetyl)-2-phenyl-5-(piperazine-1-carbonyl)pyrrolidine-3-carbonyl]benzonitrile Traditional Name: 4-[4-(3,4-dimethoxyphenyl)-1-(2-methoxyacetyl)-2-phenyl-5-(piperazine-1-carbonyl)pyrrolidine-3-carbonyl]benzonitrile Formula: C34H36N4O6 MolecularWeight: 596.67284

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC(=C(C=C3)OC)OC)C(=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

Isomeric SMILES

COCC(=O)N1C(C(C(C1C(=O)N2CCNCC2)C3=CC(=C(C=C3)OC)OC)C(=O)C4=CC=C(C=C4)C#N)C5=CC=CC=C5

InChI

InChI=1S/C34H36N4O6/c1-42-21-28(39)38-31(23-7-5-4-6-8-23)30(33(40)24-11-9-22(20-35)10-12-24)29(25-13-14-26(43-2)27(19-25)44-3)32(38)34(41)37-17-15-36-16-18-37/h4-14,19,29-32,36H,15-18,21H2,1-3H3