(2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)-3-oxidanylidene-2-(2-oxidanylidenepyridin-1-yl)propanamide

Systemtic Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)-3-oxidanylidene-2-(2-oxidanylidenepyridin-1-yl)propanamide Openeye Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)-3-oxo-2-(2-oxo-1-pyridyl)propanamide CAS Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)-3-oxo-2-(2-oxo-1-pyridinyl)propanamide IUPAC Name: (2S)-N-(1,3-benzodioxol-5-ylmethyl)-3-(3-nitrophenyl)-3-oxo-2-(2-oxopyridin-1-yl)propanamide Traditional Name: (2S)-3-keto-2-(2-keto-1-pyridyl)-3-(3-nitrophenyl)-N-piperonyl-propionamide Formula: C22H17N3O7 MolecularWeight: 435.38628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(C(=O)C3=CC(=CC=C3)[N+](=O)[O-])N4C=CC=CC4=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)[C@H](C(=O)C3=CC(=CC=C3)[N+](=O)[O-])N4C=CC=CC4=O

InChI

InChI=1S/C22H17N3O7/c26-19-6-1-2-9-24(19)20(21(27)15-4-3-5-16(11-15)25(29)30)22(28)23-12-14-7-8-17-18(10-14)32-13-31-17/h1-11,20H,12-13H2,(H,23,28)/t20-/m0/s1