methyl 4-[(E)-[(4-azanyl-1,2,4-triazol-3-yl)hydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[(4-azanyl-1,2,4-triazol-3-yl)hydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[(4-amino-1,2,4-triazol-3-yl)hydrazono]methyl]benzoate CAS Name: 4-[(E)-[(4-amino-1,2,4-triazol-3-yl)hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[(4-amino-1,2,4-triazol-3-yl)hydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[(4-amino-1,2,4-triazol-3-yl)hydrazono]methyl]benzoic acid methyl ester Formula: C11H12N6O2 MolecularWeight: 260.25198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC2=NN=CN2N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/NC2=NN=CN2N

InChI

InChI=1S/C11H12N6O2/c1-19-10(18)9-4-2-8(3-5-9)6-13-15-11-16-14-7-17(11)12/h2-7H,12H2,1H3,(H,15,16)/b13-6+