2-(3,4-dimethoxyphenyl)-3-(4-oxidanylbut-1-ynyl)chromen-4-one

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-(4-oxidanylbut-1-ynyl)chromen-4-one Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(4-hydroxybut-1-ynyl)chromen-4-one CAS Name: 2-(3,4-dimethoxyphenyl)-3-(4-hydroxybut-1-ynyl)-1-benzopyran-4-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(4-hydroxybut-1-ynyl)chromen-4-one Traditional Name: 2-(3,4-dimethoxyphenyl)-3-(4-hydroxybut-1-ynyl)chromone Formula: C21H18O5 MolecularWeight: 350.36462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)C#CCCO)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)C#CCCO)OC

InChI

InChI=1S/C21H18O5/c1-24-18-11-10-14(13-19(18)25-2)21-16(8-5-6-12-22)20(23)15-7-3-4-9-17(15)26-21/h3-4,7,9-11,13,22H,6,12H2,1-2H3