4-[2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: 4-[2-(3-cyano-5-nitro-2-oxidanylidene-pyridin-1-yl)ethanoyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: 4-[2-(3-cyano-5-nitro-2-oxo-1-pyridyl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: 4-[2-(3-cyano-5-nitro-2-oxo-1-pyridinyl)-1-oxoethyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: 4-[2-(3-cyano-5-nitro-2-oxopyridin-1-yl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-[2-(3-cyano-2-keto-5-nitro-1-pyridyl)acetyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C17H13N5O6 MolecularWeight: 383.31502

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2N1C(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-])C(=O)N

Isomeric SMILES

C1C(OC2=CC=CC=C2N1C(=O)CN3C=C(C=C(C3=O)C#N)[N+](=O)[O-])C(=O)N

InChI

InChI=1S/C17H13N5O6/c18-6-10-5-11(22(26)27)7-20(17(10)25)9-15(23)21-8-14(16(19)24)28-13-4-2-1-3-12(13)21/h1-5,7,14H,8-9H2,(H2,19,24)