methyl 4-[[3-(3-methylidene-5-oxidanylidene-pyrazolidin-4-yl)propanoylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[[3-(3-methylidene-5-oxidanylidene-pyrazolidin-4-yl)propanoylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[[3-(3-methylene-5-oxo-pyrazolidin-4-yl)propanoylhydrazono]methyl]benzoate CAS Name: 4-[[[3-(3-methylene-5-oxo-4-pyrazolidinyl)-1-oxopropyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-methylidene-5-oxopyrazolidin-4-yl)propanoylhydrazinylidene]methyl]benzoate Traditional Name: 4-[[3-(3-keto-5-methylene-pyrazolidin-4-yl)propanoylhydrazono]methyl]benzoic acid methyl ester Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CCC2C(=C)NNC2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C=NNC(=O)CCC2C(=C)NNC2=O

InChI

InChI=1S/C16H18N4O4/c1-10-13(15(22)20-18-10)7-8-14(21)19-17-9-11-3-5-12(6-4-11)16(23)24-2/h3-6,9,13,18H,1,7-8H2,2H3,(H,19,21)(H,20,22)