ethyl 4-[3-(4-cyano-4-phenyl-piperidin-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: ethyl 4-[3-(4-cyano-4-phenyl-piperidin-1-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: ethyl 4-[3-(4-cyano-4-phenyl-1-piperidyl)-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-(4-cyano-4-phenyl-1-piperidinyl)-2,5-dioxo-1-pyrrolidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(4-cyano-4-phenylpiperidin-1-yl)-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-(4-cyano-4-phenyl-piperidino)-2,5-diketo-pyrrolidino]benzoic acid ethyl ester Formula: C25H25N3O4 MolecularWeight: 431.4837

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCC(CC3)(C#N)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCC(CC3)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O4/c1-2-32-24(31)18-8-10-20(11-9-18)28-22(29)16-21(23(28)30)27-14-12-25(17-26,13-15-27)19-6-4-3-5-7-19/h3-11,21H,2,12-16H2,1H3