(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-(6-cyano-1-ethyl-indol-2-yl)-2-(cyclopropylamino)butanoate

Systemtic Name: (1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl) 4-(6-cyano-1-ethyl-indol-2-yl)-2-(cyclopropylamino)butanoate Openeye Name: (1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl) 4-(6-cyano-1-ethyl-indol-2-yl)-2-(cyclopropylamino)butanoate CAS Name: 4-(6-cyano-1-ethyl-2-indolyl)-2-(cyclopropylamino)butanoic acid [1-oxo-1-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: (1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 4-(6-cyano-1-ethylindol-2-yl)-2-(cyclopropylamino)butanoate Traditional Name: 4-(6-cyano-1-ethyl-indol-2-yl)-2-(cyclopropylamino)butyric acid (2-keto-1-methyl-2-pyrrolidino-ethyl) ester Formula: C25H32N4O3 MolecularWeight: 436.54658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C#N)CCC(C(=O)OC(C)C(=O)N3CCCC3)NC4CC4

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C#N)CCC(C(=O)OC(C)C(=O)N3CCCC3)NC4CC4

InChI

InChI=1S/C25H32N4O3/c1-3-29-21(15-19-7-6-18(16-26)14-23(19)29)10-11-22(27-20-8-9-20)25(31)32-17(2)24(30)28-12-4-5-13-28/h6-7,14-15,17,20,22,27H,3-5,8-13H2,1-2H3