6-butoxy-7-chloranyl-4-methyl-chromen-2-one

Systemtic Name: 6-butoxy-7-chloranyl-4-methyl-chromen-2-one Openeye Name: 6-butoxy-7-chloro-4-methyl-chromen-2-one CAS Name: 6-butoxy-7-chloro-4-methyl-1-benzopyran-2-one IUPAC Name: 6-butoxy-7-chloro-4-methylchromen-2-one Traditional Name: 6-butoxy-7-chloro-4-methyl-coumarin Formula: C14H15ClO3 MolecularWeight: 266.7201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)C(=CC(=O)O2)C)Cl

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)C(=CC(=O)O2)C)Cl

InChI

InChI=1S/C14H15ClO3/c1-3-4-5-17-13-7-10-9(2)6-14(16)18-12(10)8-11(13)15/h6-8H,3-5H2,1-2H3