N-(4-azanyl-2-oxidanylidene-1H-pyridin-3-yl)-4-(2-methylpropoxy)-3-nitro-benzamide

Systemtic Name: N-(4-azanyl-2-oxidanylidene-1H-pyridin-3-yl)-4-(2-methylpropoxy)-3-nitro-benzamide Openeye Name: N-(4-amino-2-oxo-1H-pyridin-3-yl)-4-isobutoxy-3-nitro-benzamide CAS Name: N-(4-amino-2-oxo-1H-pyridin-3-yl)-4-(2-methylpropoxy)-3-nitrobenzamide IUPAC Name: N-(4-amino-2-oxo-1H-pyridin-3-yl)-4-(2-methylpropoxy)-3-nitrobenzamide Traditional Name: N-(4-amino-2-keto-1H-pyridin-3-yl)-4-isobutoxy-3-nitro-benzamide Formula: C16H18N4O5 MolecularWeight: 346.33792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)NC2=C(C=CNC2=O)N)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)NC2=C(C=CNC2=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H18N4O5/c1-9(2)8-25-13-4-3-10(7-12(13)20(23)24)15(21)19-14-11(17)5-6-18-16(14)22/h3-7,9H,8H2,1-2H3,(H,19,21)(H3,17,18,22)