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

Systemtic Name: sodium (E)-3-oxidanylidene-3-(4-pentylphenyl)prop-1-en-1-olate Openeye Name: sodium (E)-3-oxo-3-(4-pentylphenyl)prop-1-en-1-olate CAS Name: sodium (E)-3-oxo-3-(4-pentylphenyl)-1-propen-1-olate IUPAC Name: sodium (E)-3-oxo-3-(4-pentylphenyl)prop-1-en-1-olate Traditional Name: sodium (E)-3-(4-amylphenyl)-3-keto-prop-1-en-1-olate Formula: C14H17NaO2 MolecularWeight: 240.27335

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)C=C[O-].[Na+]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)/C=C/[O-].[Na+]

InChI

InChI=1S/C14H18O2.Na/c1-2-3-4-5-12-6-8-13(9-7-12)14(16)10-11-15;/h6-11,15H,2-5H2,1H3;/q;+1/p-1/b11-10+;