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

Systemtic Name: ethyl 4-[2-(3-azanyl-1-ethanoyl-5-oxidanylidene-pyrazol-4-ylidene)hydrazinyl]benzoate Openeye Name: ethyl 4-[2-(1-acetyl-3-amino-5-oxo-pyrazol-4-ylidene)hydrazino]benzoate CAS Name: 4-[2-(1-acetyl-3-amino-5-oxo-4-pyrazolylidene)hydrazinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(1-acetyl-3-amino-5-oxopyrazol-4-ylidene)hydrazinyl]benzoate Traditional Name: 4-[N'-(1-acetyl-3-amino-5-keto-2-pyrazolin-4-ylidene)hydrazino]benzoic acid ethyl ester Formula: C14H15N5O4 MolecularWeight: 317.3

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N5O4/c1-3-23-14(22)9-4-6-10(7-5-9)16-17-11-12(15)18-19(8(2)20)13(11)21/h4-7,16H,3H2,1-2H3,(H2,15,18)