4-(chloromethyl)-6,8-dimethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-(chloromethyl)-6,8-dimethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-(chloromethyl)-7-hydroxy-6,8-dimethyl-chromen-2-one CAS Name: 4-(chloromethyl)-7-hydroxy-6,8-dimethyl-1-benzopyran-2-one IUPAC Name: 4-(chloromethyl)-7-hydroxy-6,8-dimethylchromen-2-one Traditional Name: 4-(chloromethyl)-7-hydroxy-6,8-dimethyl-coumarin Formula: C12H11ClO3 MolecularWeight: 238.66694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C(=CC(=O)O2)CCl)C)O

Isomeric SMILES

CC1=C(C(=C2C(=C1)C(=CC(=O)O2)CCl)C)O

InChI

InChI=1S/C12H11ClO3/c1-6-3-9-8(5-13)4-10(14)16-12(9)7(2)11(6)15/h3-4,15H,5H2,1-2H3