[4-[[(4-methyl-5-oxidanylidene-1,4-dihydropyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[[(4-methyl-5-oxidanylidene-1,4-dihydropyrazol-3-yl)carbonylhydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Openeye Name: [4-[[(4-methyl-5-oxo-1,4-dihydropyrazole-3-carbonyl)hydrazono]methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[[[(4-methyl-5-oxo-1,4-dihydropyrazol-3-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[[(4-methyl-5-oxo-1,4-dihydropyrazole-3-carbonyl)hydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[[(5-keto-4-methyl-2-pyrazoline-3-carbonyl)hydrazono]methyl]phenyl] ester Formula: C18H15N5O4 MolecularWeight: 365.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NNC1=O)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

CC1C(=NNC1=O)C(=O)NN=CC2=CC=C(C=C2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H15N5O4/c1-11-15(21-23-16(11)24)17(25)22-20-9-12-4-6-14(7-5-12)27-18(26)13-3-2-8-19-10-13/h2-11H,1H3,(H,22,25)(H,23,24)