sodium 2-[(E)-2-methyl-3-(4-methylphenyl)prop-2-enoyl]phenolate

Systemtic Name: sodium 2-[(E)-2-methyl-3-(4-methylphenyl)prop-2-enoyl]phenolate Openeye Name: sodium 2-[(E)-2-methyl-3-(p-tolyl)prop-2-enoyl]phenolate CAS Name: sodium 2-[(E)-2-methyl-3-(4-methylphenyl)-1-oxoprop-2-enyl]phenolate IUPAC Name: sodium 2-[(E)-2-methyl-3-(4-methylphenyl)prop-2-enoyl]phenolate Traditional Name: sodium 2-[(E)-2-methyl-3-(p-tolyl)acryloyl]phenolate Formula: C17H15NaO2 MolecularWeight: 274.28957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C)C(=O)C2=CC=CC=C2[O-].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C)/C(=O)C2=CC=CC=C2[O-].[Na+]

InChI

InChI=1S/C17H16O2.Na/c1-12-7-9-14(10-8-12)11-13(2)17(19)15-5-3-4-6-16(15)18;/h3-11,18H,1-2H3;/q;+1/p-1/b13-11+;