[azanyl-[(2-methoxy-4-nitro-phenyl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium

Systemtic Name: [azanyl-[(2-methoxy-4-nitro-phenyl)amino]methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium Openeye Name: [amino-(2-methoxy-4-nitro-anilino)methylene]-(4,6-dimethylpyrimidin-2-yl)ammonium CAS Name: [amino-(2-methoxy-4-nitroanilino)methylidene]-(4,6-dimethyl-2-pyrimidinyl)ammonium IUPAC Name: [amino-(2-methoxy-4-nitroanilino)methylidene]-(4,6-dimethylpyrimidin-2-yl)azanium Traditional Name: [amino-(2-methoxy-4-nitro-anilino)methylene]-(4,6-dimethylpyrimidin-2-yl)ammonium Formula: C14H17N6O3+ MolecularWeight: 317.32318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)[NH+]=C(N)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)[NH+]=C(N)NC2=C(C=C(C=C2)[N+](=O)[O-])OC)C

InChI

InChI=1S/C14H16N6O3/c1-8-6-9(2)17-14(16-8)19-13(15)18-11-5-4-10(20(21)22)7-12(11)23-3/h4-7H,1-3H3,(H3,15,16,17,18,19)/p+1