6-chloranyl-4-methyl-7-oxidanyl-3-propyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-oxidanyl-3-propyl-chromen-2-one Openeye Name: 6-chloro-7-hydroxy-4-methyl-3-propyl-chromen-2-one CAS Name: 6-chloro-7-hydroxy-4-methyl-3-propyl-1-benzopyran-2-one IUPAC Name: 6-chloro-7-hydroxy-4-methyl-3-propylchromen-2-one Traditional Name: 6-chloro-7-hydroxy-4-methyl-3-propyl-coumarin Formula: C13H13ClO3 MolecularWeight: 252.69352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=CC(=C(C=C2OC1=O)O)Cl)C

Isomeric SMILES

CCCC1=C(C2=CC(=C(C=C2OC1=O)O)Cl)C

InChI

InChI=1S/C13H13ClO3/c1-3-4-8-7(2)9-5-10(14)11(15)6-12(9)17-13(8)16/h5-6,15H,3-4H2,1-2H3