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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-(3-oxidanylpent-1-ynyl)chromen-4-one Openeye Name: 2-(3,4-dimethoxyphenyl)-3-(3-hydroxypent-1-ynyl)chromen-4-one CAS Name: 2-(3,4-dimethoxyphenyl)-3-(3-hydroxypent-1-ynyl)-1-benzopyran-4-one IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-(3-hydroxypent-1-ynyl)chromen-4-one Traditional Name: 2-(3,4-dimethoxyphenyl)-3-(3-hydroxypent-1-ynyl)chromone Formula: C22H20O5 MolecularWeight: 364.3912

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)OC)O

Isomeric SMILES

CCC(C#CC1=C(OC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)OC)OC)O

InChI

InChI=1S/C22H20O5/c1-4-15(23)10-11-17-21(24)16-7-5-6-8-18(16)27-22(17)14-9-12-19(25-2)20(13-14)26-3/h5-9,12-13,15,23H,4H2,1-3H3