6-(3-chloranyl-3-methyl-2-oxidanyl-butyl)-7-methoxy-chromen-2-one

Systemtic Name: 6-(3-chloranyl-3-methyl-2-oxidanyl-butyl)-7-methoxy-chromen-2-one Openeye Name: 6-(3-chloro-2-hydroxy-3-methyl-butyl)-7-methoxy-chromen-2-one CAS Name: 6-(3-chloro-2-hydroxy-3-methylbutyl)-7-methoxy-1-benzopyran-2-one IUPAC Name: 6-(3-chloro-2-hydroxy-3-methylbutyl)-7-methoxychromen-2-one Traditional Name: 6-(3-chloro-2-hydroxy-3-methyl-butyl)-7-methoxy-coumarin Formula: C15H17ClO4 MolecularWeight: 296.74608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CC1=C(C=C2C(=C1)C=CC(=O)O2)OC)O)Cl

Isomeric SMILES

CC(C)(C(CC1=C(C=C2C(=C1)C=CC(=O)O2)OC)O)Cl

InChI

InChI=1S/C15H17ClO4/c1-15(2,16)13(17)7-10-6-9-4-5-14(18)20-12(9)8-11(10)19-3/h4-6,8,13,17H,7H2,1-3H3