(E)-1-(6-chloranyl-1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-one

Systemtic Name: (E)-1-(6-chloranyl-1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-one Openeye Name: (E)-1-(6-chloro-1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-one CAS Name: (E)-1-(6-chloro-1,3-benzodioxol-5-yl)-4,4-dimethyl-1-penten-3-one IUPAC Name: (E)-1-(6-chloro-1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-one Traditional Name: (E)-1-(6-chloro-1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-one Formula: C14H15ClO3 MolecularWeight: 266.7201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C=CC1=CC2=C(C=C1Cl)OCO2

Isomeric SMILES

CC(C)(C)C(=O)/C=C/C1=CC2=C(C=C1Cl)OCO2

InChI

InChI=1S/C14H15ClO3/c1-14(2,3)13(16)5-4-9-6-11-12(7-10(9)15)18-8-17-11/h4-7H,8H2,1-3H3/b5-4+