[8-(3-methylbut-2-enyl)-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl] benzoate

Systemtic Name: [8-(3-methylbut-2-enyl)-5-oxidanyl-4-oxidanylidene-2-phenyl-chromen-7-yl] benzoate Openeye Name: [5-hydroxy-8-(3-methylbut-2-enyl)-4-oxo-2-phenyl-chromen-7-yl] benzoate CAS Name: benzoic acid [5-hydroxy-8-(3-methylbut-2-enyl)-4-oxo-2-phenyl-1-benzopyran-7-yl] ester IUPAC Name: [5-hydroxy-8-(3-methylbut-2-enyl)-4-oxo-2-phenylchromen-7-yl] benzoate Traditional Name: benzoic acid [5-hydroxy-4-keto-8-(3-methylbut-2-enyl)-2-phenyl-chromen-7-yl] ester Formula: C27H22O5 MolecularWeight: 426.46058

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C(C2=C1OC(=CC2=O)C3=CC=CC=C3)O)OC(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC(=CCC1=C(C=C(C2=C1OC(=CC2=O)C3=CC=CC=C3)O)OC(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C27H22O5/c1-17(2)13-14-20-24(32-27(30)19-11-7-4-8-12-19)16-22(29)25-21(28)15-23(31-26(20)25)18-9-5-3-6-10-18/h3-13,15-16,29H,14H2,1-2H3