ethyl 4-[2-(3-azanyl-5-azanylidene-1-methyl-pyrazol-4-ylidene)hydrazinyl]benzoate

Systemtic Name: ethyl 4-[2-(3-azanyl-5-azanylidene-1-methyl-pyrazol-4-ylidene)hydrazinyl]benzoate Openeye Name: ethyl 4-[2-(3-amino-5-imino-1-methyl-pyrazol-4-ylidene)hydrazino]benzoate CAS Name: 4-[2-(3-amino-5-imino-1-methyl-4-pyrazolylidene)hydrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-amino-5-imino-1-methylpyrazol-4-ylidene)hydrazinyl]benzoate Traditional Name: 4-[N'-(3-amino-5-imino-1-methyl-2-pyrazolin-4-ylidene)hydrazino]benzoic acid ethyl ester Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN(C2=N)C)N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NN=C2C(=NN(C2=N)C)N

InChI

InChI=1S/C13H16N6O2/c1-3-21-13(20)8-4-6-9(7-5-8)16-17-10-11(14)18-19(2)12(10)15/h4-7,15-16H,3H2,1-2H3,(H2,14,18)