3-hexyl-7-[2-(3-methoxyphenyl)-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one

Systemtic Name: 3-hexyl-7-[2-(3-methoxyphenyl)-2-oxidanylidene-ethoxy]-4-methyl-chromen-2-one Openeye Name: 3-hexyl-7-[2-(3-methoxyphenyl)-2-oxo-ethoxy]-4-methyl-chromen-2-one CAS Name: 3-hexyl-7-[2-(3-methoxyphenyl)-2-oxoethoxy]-4-methyl-1-benzopyran-2-one IUPAC Name: 3-hexyl-7-[2-(3-methoxyphenyl)-2-oxoethoxy]-4-methylchromen-2-one Traditional Name: 3-hexyl-7-[2-keto-2-(3-methoxyphenyl)ethoxy]-4-methyl-coumarin Formula: C25H28O5 MolecularWeight: 408.48682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=CC(=CC=C3)OC)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)C3=CC(=CC=C3)OC)OC1=O)C

InChI

InChI=1S/C25H28O5/c1-4-5-6-7-11-22-17(2)21-13-12-20(15-24(21)30-25(22)27)29-16-23(26)18-9-8-10-19(14-18)28-3/h8-10,12-15H,4-7,11,16H2,1-3H3