5-(6-chloranyl-2-methyl-4-oxidanylidene-3H-chromen-2-yl)pentanoic acid

Systemtic Name: 5-(6-chloranyl-2-methyl-4-oxidanylidene-3H-chromen-2-yl)pentanoic acid Openeye Name: 5-(6-chloro-2-methyl-4-oxo-chroman-2-yl)pentanoic acid CAS Name: 5-(6-chloro-2-methyl-4-oxo-3,4-dihydro-2H-1-benzopyran-2-yl)pentanoic acid IUPAC Name: 5-(6-chloro-2-methyl-4-oxo-3H-chromen-2-yl)pentanoic acid Traditional Name: 5-(6-chloro-4-keto-2-methyl-chroman-2-yl)valeric acid Formula: C15H17ClO4 MolecularWeight: 296.74608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=CC(=C2)Cl)CCCCC(=O)O

Isomeric SMILES

CC1(CC(=O)C2=C(O1)C=CC(=C2)Cl)CCCCC(=O)O

InChI

InChI=1S/C15H17ClO4/c1-15(7-3-2-4-14(18)19)9-12(17)11-8-10(16)5-6-13(11)20-15/h5-6,8H,2-4,7,9H2,1H3,(H,18,19)