7-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethoxy]-4,8-dimethyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 7-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethoxy]-4,8-dimethyl-3-(phenylmethyl)chromen-2-one Openeye Name: 7-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethoxy]-3-benzyl-4,8-dimethyl-chromen-2-one CAS Name: 7-[2-(1,3-benzodioxol-5-yl)-2-oxoethoxy]-4,8-dimethyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 7-[2-(1,3-benzodioxol-5-yl)-2-oxoethoxy]-3-benzyl-4,8-dimethylchromen-2-one Traditional Name: 7-[2-(1,3-benzodioxol-5-yl)-2-keto-ethoxy]-3-benzyl-4,8-dimethyl-coumarin Formula: C27H22O6 MolecularWeight: 442.45998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)C3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C27H22O6/c1-16-20-9-11-23(30-14-22(28)19-8-10-24-25(13-19)32-15-31-24)17(2)26(20)33-27(29)21(16)12-18-6-4-3-5-7-18/h3-11,13H,12,14-15H2,1-2H3