4-[(Z)-(3,5-dimethyl-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(Z)-(3,5-dimethyl-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(Z)-(3,5-dimethyl-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(Z)-(3,5-dimethyl-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(Z)-(3,5-dimethyl-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(Z)-(3,5-dimethyl-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-6-nitro-phenolate Formula: C12H12N5O4- MolecularWeight: 290.25478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N=CC2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=NN=C(N1/N=C\C2=CC(=C(C(=C2)OC)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C12H13N5O4/c1-7-14-15-8(2)16(7)13-6-9-4-10(17(19)20)12(18)11(5-9)21-3/h4-6,18H,1-3H3/p-1/b13-6-