sodium propyl 4-oxidanylidenecyclohexa-2,5-diene-1-carboxylate

Systemtic Name: sodium propyl 4-oxidanylidenecyclohexa-2,5-diene-1-carboxylate Openeye Name: sodium propyl 4-oxocyclohexa-2,5-diene-1-carboxylate CAS Name: sodium 4-oxo-1-cyclohexa-2,5-dienecarboxylic acid propyl ester IUPAC Name: sodium propyl 4-oxocyclohexa-2,5-diene-1-carboxylate Traditional Name: sodium 4-ketocyclohexa-2,5-diene-1-carboxylic acid propyl ester Formula: C10H12NaO3+ MolecularWeight: 203.19025

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1C=CC(=O)C=C1.[Na+]

Isomeric SMILES

CCCOC(=O)C1C=CC(=O)C=C1.[Na+]

InChI

InChI=1S/C10H12O3.Na/c1-2-7-13-10(12)8-3-5-9(11)6-4-8;/h3-6,8H,2,7H2,1H3;/q;+1