sodium (E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: sodium (E)-3-(4-methylphenyl)-3-oxidanylidene-prop-1-en-1-olate Openeye Name: sodium (E)-3-oxo-3-(p-tolyl)prop-1-en-1-olate CAS Name: sodium (E)-3-(4-methylphenyl)-3-oxo-1-propen-1-olate IUPAC Name: sodium (E)-3-(4-methylphenyl)-3-oxoprop-1-en-1-olate Traditional Name: sodium (E)-3-keto-3-(p-tolyl)prop-1-en-1-olate Formula: C10H9NaO2 MolecularWeight: 184.16703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/[O-].[Na+]

InChI

InChI=1S/C10H10O2.Na/c1-8-2-4-9(5-3-8)10(12)6-7-11;/h2-7,11H,1H3;/q;+1/p-1/b7-6+;