2,2-dimethyl-6-nitro-4-(1-oxidanidylpyridin-1-ium-3-yl)-3H-1,4-benzoxazine

Systemtic Name: 2,2-dimethyl-6-nitro-4-(1-oxidanidylpyridin-1-ium-3-yl)-3H-1,4-benzoxazine Openeye Name: 2,2-dimethyl-6-nitro-4-(1-oxidopyridin-1-ium-3-yl)-3H-1,4-benzoxazine CAS Name: 2,2-dimethyl-6-nitro-4-(1-oxido-3-pyridin-1-iumyl)-3H-1,4-benzoxazine IUPAC Name: 2,2-dimethyl-6-nitro-4-(1-oxidopyridin-1-ium-3-yl)-3H-1,4-benzoxazine Traditional Name: 2,2-dimethyl-6-nitro-4-(1-oxidopyridin-1-ium-3-yl)-3H-1,4-benzoxazine Formula: C15H15N3O4 MolecularWeight: 301.2973

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O4/c1-15(2)10-17(12-4-3-7-16(19)9-12)13-8-11(18(20)21)5-6-14(13)22-15/h3-9H,10H2,1-2H3