[2-(oxidanylidenemethylidene)piperidin-1-yl] 4-(6-cyano-1-ethyl-indol-2-yl)-2-pyrrolidin-1-yl-butanoate

Systemtic Name: [2-(oxidanylidenemethylidene)piperidin-1-yl] 4-(6-cyano-1-ethyl-indol-2-yl)-2-pyrrolidin-1-yl-butanoate Openeye Name: [2-(oxomethylene)-1-piperidyl] 4-(6-cyano-1-ethyl-indol-2-yl)-2-pyrrolidin-1-yl-butanoate CAS Name: 4-(6-cyano-1-ethyl-2-indolyl)-2-(1-pyrrolidinyl)butanoic acid [2-(oxomethylidene)-1-piperidinyl] ester IUPAC Name: [2-(oxomethylidene)piperidin-1-yl] 4-(6-cyano-1-ethylindol-2-yl)-2-pyrrolidin-1-ylbutanoate Traditional Name: 4-(6-cyano-1-ethyl-indol-2-yl)-2-pyrrolidino-butyric acid [2-(ketomethylene)piperidino] ester Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C#N)CCC(C(=O)ON3CCCCC3=C=O)N4CCCC4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C#N)CCC(C(=O)ON3CCCCC3=C=O)N4CCCC4

InChI

InChI=1S/C25H30N4O3/c1-2-28-21(16-20-9-8-19(17-26)15-24(20)28)10-11-23(27-12-5-6-13-27)25(31)32-29-14-4-3-7-22(29)18-30/h8-9,15-16,23H,2-7,10-14H2,1H3