ethyl 4-[[2-[3-[(3-cyanophenyl)methyl]-2-oxidanylidene-1H-quinoxalin-6-yl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]amino]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[2-[3-[(3-cyanophenyl)methyl]-2-oxidanylidene-1H-quinoxalin-6-yl]-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]amino]-3-oxidanylidene-butanoate Openeye Name: ethyl 4-[[1-[3-[(3-cyanophenyl)methyl]-2-oxo-1H-quinoxalin-6-yl]-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]amino]-3-oxo-butanoate CAS Name: 4-[[2-[3-[(3-cyanophenyl)methyl]-2-oxo-1H-quinoxalin-6-yl]-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]amino]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-[(3-cyanophenyl)methyl]-2-oxo-1H-quinoxalin-6-yl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]amino]-3-oxobutanoate Traditional Name: 4-[[1-[3-(3-cyanobenzyl)-2-keto-1H-quinoxalin-6-yl]-2-keto-1-methyl-2-pyrrolidino-ethyl]amino]-3-keto-butyric acid ethyl ester Formula: C29H31N5O5 MolecularWeight: 529.58694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CNC(C)(C1=CC2=C(C=C1)NC(=O)C(=N2)CC3=CC=CC(=C3)C#N)C(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)CC(=O)CNC(C)(C1=CC2=C(C=C1)NC(=O)C(=N2)CC3=CC=CC(=C3)C#N)C(=O)N4CCCC4

InChI

InChI=1S/C29H31N5O5/c1-3-39-26(36)16-22(35)18-31-29(2,28(38)34-11-4-5-12-34)21-9-10-23-24(15-21)32-25(27(37)33-23)14-19-7-6-8-20(13-19)17-30/h6-10,13,15,31H,3-5,11-12,14,16,18H2,1-2H3,(H,33,37)