methyl 2-(4-cyanophenyl)-1-(2-phenoxyethanoyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 2-(4-cyanophenyl)-1-(2-phenoxyethanoyl)-5-piperazin-1-ylcarbonyl-pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-cyanophenyl)-1-(2-phenoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate CAS Name: 2-(4-cyanophenyl)-1-(1-oxo-2-phenoxyethyl)-5-[oxo(1-piperazinyl)methyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-cyanophenyl)-1-(2-phenoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylate Traditional Name: 2-(4-cyanophenyl)-1-(2-phenoxyacetyl)-5-(piperazine-1-carbonyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C26H28N4O5 MolecularWeight: 476.52432

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(N(C1C2=CC=C(C=C2)C#N)C(=O)COC3=CC=CC=C3)C(=O)N4CCNCC4

Isomeric SMILES

COC(=O)C1CC(N(C1C2=CC=C(C=C2)C#N)C(=O)COC3=CC=CC=C3)C(=O)N4CCNCC4

InChI

InChI=1S/C26H28N4O5/c1-34-26(33)21-15-22(25(32)29-13-11-28-12-14-29)30(23(31)17-35-20-5-3-2-4-6-20)24(21)19-9-7-18(16-27)8-10-19/h2-10,21-22,24,28H,11-15,17H2,1H3