sodium (E)-3-cyclohexa-1,3-dien-1-ylprop-2-enoate

Systemtic Name: sodium (E)-3-cyclohexa-1,3-dien-1-ylprop-2-enoate Openeye Name: sodium (E)-3-cyclohexa-1,3-dien-1-ylprop-2-enoate CAS Name: sodium (E)-3-(1-cyclohexa-1,3-dienyl)-2-propenoate IUPAC Name: sodium (E)-3-cyclohexa-1,3-dien-1-ylprop-2-enoate Traditional Name: sodium (E)-3-cyclohexa-1,3-dien-1-ylacrylate Formula: C9H9NaO2 MolecularWeight: 172.15633

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)C=CC(=O)[O-].[Na+]

Isomeric SMILES

C1CC(=CC=C1)/C=C/C(=O)[O-].[Na+]

InChI

InChI=1S/C9H10O2.Na/c10-9(11)7-6-8-4-2-1-3-5-8;/h1-2,4,6-7H,3,5H2,(H,10,11);/q;+1/p-1/b7-6+;