5-chloranyl-1-(6-methoxy-1,3-benzodioxol-5-yl)pentan-1-one

Systemtic Name: 5-chloranyl-1-(6-methoxy-1,3-benzodioxol-5-yl)pentan-1-one Openeye Name: 5-chloro-1-(6-methoxy-1,3-benzodioxol-5-yl)pentan-1-one CAS Name: 5-chloro-1-(6-methoxy-1,3-benzodioxol-5-yl)-1-pentanone IUPAC Name: 5-chloro-1-(6-methoxy-1,3-benzodioxol-5-yl)pentan-1-one Traditional Name: 5-chloro-1-(6-methoxy-1,3-benzodioxol-5-yl)pentan-1-one Formula: C13H15ClO4 MolecularWeight: 270.7088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C(=O)CCCCCl)OCO2

Isomeric SMILES

COC1=CC2=C(C=C1C(=O)CCCCCl)OCO2

InChI

InChI=1S/C13H15ClO4/c1-16-11-7-13-12(17-8-18-13)6-9(11)10(15)4-2-3-5-14/h6-7H,2-5,8H2,1H3