(3E)-2,2-dimethyl-5-oxidanyl-3-(oxidanylmethylidene)-7-(1-phenethyloxypropan-2-yl)chromen-4-one

Systemtic Name: (3E)-2,2-dimethyl-5-oxidanyl-3-(oxidanylmethylidene)-7-(1-phenethyloxypropan-2-yl)chromen-4-one Openeye Name: (3E)-5-hydroxy-3-(hydroxymethylene)-2,2-dimethyl-7-(1-methyl-2-phenethyloxy-ethyl)chroman-4-one CAS Name: (3E)-5-hydroxy-3-(hydroxymethylidene)-2,2-dimethyl-7-(1-phenethyloxypropan-2-yl)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3E)-5-hydroxy-3-(hydroxymethylidene)-2,2-dimethyl-7-(1-phenethyloxypropan-2-yl)chromen-4-one Traditional Name: (3E)-5-hydroxy-3-(hydroxymethylene)-2,2-dimethyl-7-(1-methyl-2-phenethyloxy-ethyl)chroman-4-one Formula: C23H26O5 MolecularWeight: 382.44954

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCCC1=CC=CC=C1)C2=CC3=C(C(=C2)O)C(=O)C(=CO)C(O3)(C)C

Isomeric SMILES

CC(COCCC1=CC=CC=C1)C2=CC3=C(C(=C2)O)C(=O)/C(=C/O)/C(O3)(C)C

InChI

InChI=1S/C23H26O5/c1-15(14-27-10-9-16-7-5-4-6-8-16)17-11-19(25)21-20(12-17)28-23(2,3)18(13-24)22(21)26/h4-8,11-13,15,24-25H,9-10,14H2,1-3H3/b18-13-