decan-2-one; 2-oxidanyl-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-one; sodium

Systemtic Name: decan-2-one; 2-oxidanyl-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-one; sodium Openeye Name: decan-2-one; 2-hydroxy-3-(3-oxo-1-phenyl-butyl)chromen-4-one; sodium CAS Name: 2-decanone; 2-hydroxy-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-one; sodium IUPAC Name: decan-2-one; 2-hydroxy-3-(3-oxo-1-phenylbutyl)chromen-4-one; sodium Traditional Name: decan-2-one; 2-hydroxy-3-(3-keto-1-phenyl-butyl)chromone; sodium Formula: C29H36NaO5 MolecularWeight: 487.58291

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)C.CC(=O)CC(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O.[Na]

Isomeric SMILES

CCCCCCCCC(=O)C.CC(=O)CC(C1=CC=CC=C1)C2=C(OC3=CC=CC=C3C2=O)O.[Na]

InChI

InChI=1S/C19H16O4.C10H20O.Na/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;1-3-4-5-6-7-8-9-10(2)11;/h2-10,15,22H,11H2,1H3;3-9H2,1-2H3;