[3-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-5-methoxy-2-oxidanylidene-chromen-4-yl] benzoate

Systemtic Name: [3-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-5-methoxy-2-oxidanylidene-chromen-4-yl] benzoate Openeye Name: [3-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-5-methoxy-2-oxo-chromen-4-yl] benzoate CAS Name: benzoic acid [3-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-5-methoxy-2-oxo-1-benzopyran-4-yl] ester IUPAC Name: [3-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-5-methoxy-2-oxochromen-4-yl] benzoate Traditional Name: benzoic acid [3-[(2Z)-3,7-dimethylocta-2,6-dienoxy]-2-keto-5-methoxy-chromen-4-yl] ester Formula: C27H28O6 MolecularWeight: 448.50762

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCOC1=C(C2=C(C=CC=C2OC)OC1=O)OC(=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC(=CCC/C(=C\COC1=C(C2=C(C=CC=C2OC)OC1=O)OC(=O)C3=CC=CC=C3)/C)C

InChI

InChI=1S/C27H28O6/c1-18(2)10-8-11-19(3)16-17-31-25-24(33-26(28)20-12-6-5-7-13-20)23-21(30-4)14-9-15-22(23)32-27(25)29/h5-7,9-10,12-16H,8,11,17H2,1-4H3/b19-16-