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

Systemtic Name: ethyl 4-[2-(3-azanyl-5-azanylidene-1-ethanoyl-pyrazol-4-ylidene)hydrazinyl]benzoate Openeye Name: ethyl 4-[2-(1-acetyl-3-amino-5-imino-pyrazol-4-ylidene)hydrazino]benzoate CAS Name: 4-[2-(1-acetyl-3-amino-5-imino-4-pyrazolylidene)hydrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(1-acetyl-3-amino-5-iminopyrazol-4-ylidene)hydrazinyl]benzoate Traditional Name: 4-[N'-(1-acetyl-3-amino-5-imino-2-pyrazolin-4-ylidene)hydrazino]benzoic acid ethyl ester Formula: C14H16N6O3 MolecularWeight: 316.31524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N6O3/c1-3-23-14(22)9-4-6-10(7-5-9)17-18-11-12(15)19-20(8(2)21)13(11)16/h4-7,16-17H,3H2,1-2H3,(H2,15,19)