4-(chloromethyl)-6-ethyl-7-oxidanyl-chromen-2-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CCl)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CCl)O

InChI

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