N-[(2S)-butan-2-yl]-8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxamide Openeye Name: 8-methoxy-N-[(1S)-1-methylpropyl]-6-nitro-2-oxo-chromene-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-8-methoxy-6-nitro-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[(2S)-butan-2-yl]-8-methoxy-6-nitro-2-oxochromene-3-carboxamide Traditional Name: 2-keto-8-methoxy-N-[(1S)-1-methylpropyl]-6-nitro-chromene-3-carboxamide Formula: C15H16N2O6 MolecularWeight: 320.29734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC2=CC(=CC(=C2OC1=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)NC(=O)C1=CC2=CC(=CC(=C2OC1=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O6/c1-4-8(2)16-14(18)11-6-9-5-10(17(20)21)7-12(22-3)13(9)23-15(11)19/h5-8H,4H2,1-3H3,(H,16,18)/t8-/m0/s1