5-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]-4-(4-methoxyphenyl)-7-methyl-chromen-2-one

Systemtic Name: 5-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]-4-(4-methoxyphenyl)-7-methyl-chromen-2-one Openeye Name: 5-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-(4-methoxyphenyl)-7-methyl-chromen-2-one CAS Name: 5-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-(4-methoxyphenyl)-7-methyl-1-benzopyran-2-one IUPAC Name: 5-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-(4-methoxyphenyl)-7-methylchromen-2-one Traditional Name: 5-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-4-(4-methoxyphenyl)-7-methyl-coumarin Formula: C25H19ClO6 MolecularWeight: 450.86776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C3=CC=C(C=C3)OC)C(=C1)OCC4=CC5=C(C=C4Cl)OCO5

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C3=CC=C(C=C3)OC)C(=C1)OCC4=CC5=C(C=C4Cl)OCO5

InChI

InChI=1S/C25H19ClO6/c1-14-7-22(29-12-16-9-20-21(11-19(16)26)31-13-30-20)25-18(10-24(27)32-23(25)8-14)15-3-5-17(28-2)6-4-15/h3-11H,12-13H2,1-2H3