sodium 5-methyl-2-[4-oxidanylidene-4-[2-(phenylcarbonyl)hydrazinyl]butan-2-yl]hexanoate

Systemtic Name: sodium 5-methyl-2-[4-oxidanylidene-4-[2-(phenylcarbonyl)hydrazinyl]butan-2-yl]hexanoate Openeye Name: sodium 2-[3-(2-benzoylhydrazino)-1-methyl-3-oxo-propyl]-5-methyl-hexanoate CAS Name: sodium 2-[4-(benzoylhydrazo)-4-oxobutan-2-yl]-5-methylhexanoate IUPAC Name: sodium 2-[4-(2-benzoylhydrazinyl)-4-oxobutan-2-yl]-5-methylhexanoate Traditional Name: sodium 2-[3-(N'-benzoylhydrazino)-3-keto-1-methyl-propyl]-5-methyl-hexanoate Formula: C18H25N2NaO4 MolecularWeight: 356.39187

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(C)CC(=O)NNC(=O)C1=CC=CC=C1)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)CCC(C(C)CC(=O)NNC(=O)C1=CC=CC=C1)C(=O)[O-].[Na+]

InChI

InChI=1S/C18H26N2O4.Na/c1-12(2)9-10-15(18(23)24)13(3)11-16(21)19-20-17(22)14-7-5-4-6-8-14;/h4-8,12-13,15H,9-11H2,1-3H3,(H,19,21)(H,20,22)(H,23,24);/q;+1/p-1