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

Systemtic Name: sodium; 2-oxidanyl-3-(3-oxidanylidene-1-phenyl-butyl)chromen-4-one; propan-2-ol Openeye Name: sodium; 2-hydroxy-3-(3-oxo-1-phenyl-butyl)chromen-4-one; propan-2-ol CAS Name: sodium; 2-hydroxy-3-(3-oxo-1-phenylbutyl)-1-benzopyran-4-one; 2-propanol IUPAC Name: sodium; 2-hydroxy-3-(3-oxo-1-phenylbutyl)chromen-4-one; propan-2-ol Traditional Name: sodium; 2-hydroxy-3-(3-keto-1-phenyl-butyl)chromone; propan-2-ol Formula: C22H24NaO5+ MolecularWeight: 391.41273

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16O4.C3H8O.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(2)4;/h2-10,15,22H,11H2,1H3;3-4H,1-2H3;/q;;+1