sodium 2-[(2E)-2-[1-cyano-2-(4-methylphenyl)-2-oxidanylidene-ethylidene]hydrazinyl]benzoate

Systemtic Name: sodium 2-[(2E)-2-[1-cyano-2-(4-methylphenyl)-2-oxidanylidene-ethylidene]hydrazinyl]benzoate Openeye Name: sodium 2-[(2E)-2-[1-cyano-2-oxo-2-(p-tolyl)ethylidene]hydrazino]benzoate CAS Name: sodium 2-[(2E)-2-[1-cyano-2-(4-methylphenyl)-2-oxoethylidene]hydrazinyl]benzoate IUPAC Name: sodium 2-[(2E)-2-[1-cyano-2-(4-methylphenyl)-2-oxoethylidene]hydrazinyl]benzoate Traditional Name: sodium 2-[(N'E)-N'-[1-cyano-2-keto-2-(p-tolyl)ethylidene]hydrazino]benzoate Formula: C17H12N3NaO3 MolecularWeight: 329.28525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=NNC2=CC=CC=C2C(=O)[O-])C#N.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C(=N/NC2=CC=CC=C2C(=O)[O-])/C#N.[Na+]

InChI

InChI=1S/C17H13N3O3.Na/c1-11-6-8-12(9-7-11)16(21)15(10-18)20-19-14-5-3-2-4-13(14)17(22)23;/h2-9,19H,1H3,(H,22,23);/q;+1/p-1/b20-15+;