(2S)-N-[(2S)-2-ethylhexyl]-3-(3-nitrophenyl)-3-oxidanylidene-2-(2-oxidanylidenepyridin-1-yl)propanamide

Systemtic Name: (2S)-N-[(2S)-2-ethylhexyl]-3-(3-nitrophenyl)-3-oxidanylidene-2-(2-oxidanylidenepyridin-1-yl)propanamide Openeye Name: (2S)-N-[(2S)-2-ethylhexyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxo-1-pyridyl)propanamide CAS Name: (2S)-N-[(2S)-2-ethylhexyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxo-1-pyridinyl)propanamide IUPAC Name: (2S)-N-[(2S)-2-ethylhexyl]-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1-yl)propanamide Traditional Name: (2S)-N-[(2S)-2-ethylhexyl]-3-keto-2-(2-keto-1-pyridyl)-3-(3-nitrophenyl)propionamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)C(C(=O)C1=CC(=CC=C1)[N+](=O)[O-])N2C=CC=CC2=O

Isomeric SMILES

CCCC[C@H](CC)CNC(=O)[C@H](C(=O)C1=CC(=CC=C1)[N+](=O)[O-])N2C=CC=CC2=O

InChI

InChI=1S/C22H27N3O5/c1-3-5-9-16(4-2)15-23-22(28)20(24-13-7-6-12-19(24)26)21(27)17-10-8-11-18(14-17)25(29)30/h6-8,10-14,16,20H,3-5,9,15H2,1-2H3,(H,23,28)/t16-,20-/m0/s1