3-hexyl-4,8-dimethyl-7-[(3-methylphenyl)methoxy]chromen-2-one

Systemtic Name: 3-hexyl-4,8-dimethyl-7-[(3-methylphenyl)methoxy]chromen-2-one Openeye Name: 3-hexyl-4,8-dimethyl-7-(m-tolylmethoxy)chromen-2-one CAS Name: 3-hexyl-4,8-dimethyl-7-[(3-methylphenyl)methoxy]-1-benzopyran-2-one IUPAC Name: 3-hexyl-4,8-dimethyl-7-[(3-methylphenyl)methoxy]chromen-2-one Traditional Name: 3-hexyl-4,8-dimethyl-7-(3-methylbenzyl)oxy-coumarin Formula: C25H30O3 MolecularWeight: 378.5039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=CC=CC(=C3)C)C)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C(=C(C=C2)OCC3=CC=CC(=C3)C)C)OC1=O)C

InChI

InChI=1S/C25H30O3/c1-5-6-7-8-12-22-18(3)21-13-14-23(19(4)24(21)28-25(22)26)27-16-20-11-9-10-17(2)15-20/h9-11,13-15H,5-8,12,16H2,1-4H3