4-butyl-6-chloranyl-7-[(2R)-3-oxidanylidenebutan-2-yl]oxy-chromen-2-one

Systemtic Name: 4-butyl-6-chloranyl-7-[(2R)-3-oxidanylidenebutan-2-yl]oxy-chromen-2-one Openeye Name: 4-butyl-6-chloro-7-[(1R)-1-methyl-2-oxo-propoxy]chromen-2-one CAS Name: 4-butyl-6-chloro-7-[(2R)-3-oxobutan-2-yl]oxy-1-benzopyran-2-one IUPAC Name: 4-butyl-6-chloro-7-[(2R)-3-oxobutan-2-yl]oxychromen-2-one Traditional Name: 4-butyl-6-chloro-7-[(1R)-2-keto-1-methyl-propoxy]coumarin Formula: C17H19ClO4 MolecularWeight: 322.78336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(C)C(=O)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)O[C@H](C)C(=O)C

InChI

InChI=1S/C17H19ClO4/c1-4-5-6-12-7-17(20)22-15-9-16(14(18)8-13(12)15)21-11(3)10(2)19/h7-9,11H,4-6H2,1-3H3/t11-/m1/s1