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

Systemtic Name: 7-[(6-chloranyl-1,3-benzodioxol-5-yl)methoxy]-3-hexyl-4-methyl-chromen-2-one Openeye Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-3-hexyl-4-methyl-chromen-2-one CAS Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-3-hexyl-4-methyl-1-benzopyran-2-one IUPAC Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-3-hexyl-4-methylchromen-2-one Traditional Name: 7-[(6-chloro-1,3-benzodioxol-5-yl)methoxy]-3-hexyl-4-methyl-coumarin Formula: C24H25ClO5 MolecularWeight: 428.9053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC4=C(C=C3Cl)OCO4)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC3=CC4=C(C=C3Cl)OCO4)OC1=O)C

InChI

InChI=1S/C24H25ClO5/c1-3-4-5-6-7-19-15(2)18-9-8-17(11-21(18)30-24(19)26)27-13-16-10-22-23(12-20(16)25)29-14-28-22/h8-12H,3-7,13-14H2,1-2H3