sodium 4-oxidanyl-3-pentadecyl-cyclohexa-2,4-dien-1-one

Systemtic Name: sodium 4-oxidanyl-3-pentadecyl-cyclohexa-2,4-dien-1-one Openeye Name: sodium 4-hydroxy-3-pentadecyl-cyclohexa-2,4-dien-1-one CAS Name: sodium 4-hydroxy-3-pentadecyl-1-cyclohexa-2,4-dienone IUPAC Name: sodium 4-hydroxy-3-pentadecylcyclohexa-2,4-dien-1-one Traditional Name: sodium 4-hydroxy-3-pentadecyl-cyclohexa-2,4-dien-1-one Formula: C21H35NaO2 MolecularWeight: 342.49117

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=O)[CH-]C=C1O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=O)[CH-]C=C1O.[Na+]

InChI

InChI=1S/C21H35O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-18-20(22)16-17-21(19)23;/h16-18,23H,2-15H2,1H3;/q-1;+1