(E)-1-(1,3-benzodioxol-5-yl)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)prop-2-en-1-one CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)prop-2-en-1-one Formula: C17H13ClO5 MolecularWeight: 332.73512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)C2=CC3=C(C=C2)OCO3)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=C/C(=O)C2=CC3=C(C=C2)OCO3)Cl)O

InChI

InChI=1S/C17H13ClO5/c1-21-16-7-10(6-12(18)17(16)20)2-4-13(19)11-3-5-14-15(8-11)23-9-22-14/h2-8,20H,9H2,1H3/b4-2+