[6-(2-methylbut-3-en-2-yl)-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl] benzoate

Systemtic Name: [6-(2-methylbut-3-en-2-yl)-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl] benzoate Openeye Name: [6-(1,1-dimethylallyl)-5-hydroxy-4-oxo-2-phenyl-chromen-7-yl] benzoate CAS Name: benzoic acid [5-hydroxy-6-(2-methylbut-3-en-2-yl)-4-oxo-2-phenyl-1-benzopyran-7-yl] ester IUPAC Name: [5-hydroxy-6-(2-methylbut-3-en-2-yl)-4-oxo-2-phenylchromen-7-yl] benzoate Traditional Name: benzoic acid [6-(1,1-dimethylallyl)-5-hydroxy-4-keto-2-phenyl-chromen-7-yl] ester Formula: C27H22O5 MolecularWeight: 426.46058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)C1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C=C)C1=C(C=C2C(=C1O)C(=O)C=C(O2)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H22O5/c1-4-27(2,3)24-22(32-26(30)18-13-9-6-10-14-18)16-21-23(25(24)29)19(28)15-20(31-21)17-11-7-5-8-12-17/h4-16,29H,1H2,2-3H3