sodium 3-octoxy-7-oxidanyl-4-oxidanylidene-chromen-2-olate

Systemtic Name: sodium 3-octoxy-7-oxidanyl-4-oxidanylidene-chromen-2-olate Openeye Name: sodium 7-hydroxy-3-octoxy-4-oxo-chromen-2-olate CAS Name: sodium 7-hydroxy-3-octoxy-4-oxo-1-benzopyran-2-olate IUPAC Name: sodium 7-hydroxy-3-octoxy-4-oxochromen-2-olate Traditional Name: sodium 7-hydroxy-4-keto-3-octoxy-chromen-2-olate Formula: C17H21NaO5 MolecularWeight: 328.33541

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCOC1=C(OC2=C(C1=O)C=CC(=C2)O)[O-].[Na+]

InChI

InChI=1S/C17H22O5.Na/c1-2-3-4-5-6-7-10-21-16-15(19)13-9-8-12(18)11-14(13)22-17(16)20;/h8-9,11,18,20H,2-7,10H2,1H3;/q;+1/p-1