3-[(3S)-2-methyl-5-oxidanylidene-hexan-3-yl]-2-oxidanyl-chromen-4-one

Systemtic Name: 3-[(3S)-2-methyl-5-oxidanylidene-hexan-3-yl]-2-oxidanyl-chromen-4-one Openeye Name: 2-hydroxy-3-[(1S)-1-isopropyl-3-oxo-butyl]chromen-4-one CAS Name: 2-hydroxy-3-[(3S)-2-methyl-5-oxohexan-3-yl]-1-benzopyran-4-one IUPAC Name: 2-hydroxy-3-[(3S)-2-methyl-5-oxohexan-3-yl]chromen-4-one Traditional Name: 2-hydroxy-3-[(1S)-1-isopropyl-3-keto-butyl]chromone Formula: C16H18O4 MolecularWeight: 274.31172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)C)C1=C(OC2=CC=CC=C2C1=O)O

Isomeric SMILES

CC(C)[C@H](CC(=O)C)C1=C(OC2=CC=CC=C2C1=O)O

InChI

InChI=1S/C16H18O4/c1-9(2)12(8-10(3)17)14-15(18)11-6-4-5-7-13(11)20-16(14)19/h4-7,9,12,19H,8H2,1-3H3/t12-/m0/s1