[3-(2,5-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl] 3-phenylpropanoate

Systemtic Name: [3-(2,5-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl] 3-phenylpropanoate Openeye Name: [3-(2,5-dimethylphenoxy)-4-oxo-chromen-7-yl] 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid [3-(2,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2,5-dimethylphenoxy)-4-oxochromen-7-yl] 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid [3-(2,5-dimethylphenoxy)-4-keto-chromen-7-yl] ester Formula: C26H22O5 MolecularWeight: 414.44988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H22O5/c1-17-8-9-18(2)22(14-17)31-24-16-29-23-15-20(11-12-21(23)26(24)28)30-25(27)13-10-19-6-4-3-5-7-19/h3-9,11-12,14-16H,10,13H2,1-2H3