4-(3,5-dinitro-2-oxidanylidene-pyridin-1-yl)-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile

Systemtic Name: 4-(3,5-dinitro-2-oxidanylidene-pyridin-1-yl)-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile Openeye Name: 4-(3,5-dinitro-2-oxo-1-pyridyl)-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile CAS Name: 4-(3,5-dinitro-2-oxo-1-pyridinyl)-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile IUPAC Name: 4-(3,5-dinitro-2-oxopyridin-1-yl)-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile Traditional Name: 4-(2-keto-3,5-dinitro-1-pyridyl)-2,2-dimethyl-1,3-benzoxazine-6-carbonitrile Formula: C16H11N5O6 MolecularWeight: 369.28844

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)N3C=C(C=C(C3=O)[N+](=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C16H11N5O6/c1-16(2)18-14(11-5-9(7-17)3-4-13(11)27-16)19-8-10(20(23)24)6-12(15(19)22)21(25)26/h3-6,8H,1-2H3