2-[3-[6-methyl-3-(phenoxymethyl)heptyl]-2-oxidanyl-4-oxidanylidene-chromen-6-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[3-[6-methyl-3-(phenoxymethyl)heptyl]-2-oxidanyl-4-oxidanylidene-chromen-6-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-hydroxy-3-[6-methyl-3-(phenoxymethyl)heptyl]-4-oxo-chromen-6-yl]-2-oxo-acetic acid CAS Name: 2-[2-hydroxy-3-[6-methyl-3-(phenoxymethyl)heptyl]-4-oxo-1-benzopyran-6-yl]-2-oxoacetic acid IUPAC Name: 2-[2-hydroxy-3-[6-methyl-3-(phenoxymethyl)heptyl]-4-oxochromen-6-yl]-2-oxoacetic acid Traditional Name: 2-[2-hydroxy-4-keto-3-[6-methyl-3-(phenoxymethyl)heptyl]chromen-6-yl]-2-keto-acetic acid Formula: C26H28O7 MolecularWeight: 452.49632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)C(=O)O)O)COC3=CC=CC=C3

Isomeric SMILES

CC(C)CCC(CCC1=C(OC2=C(C1=O)C=C(C=C2)C(=O)C(=O)O)O)COC3=CC=CC=C3

InChI

InChI=1S/C26H28O7/c1-16(2)8-9-17(15-32-19-6-4-3-5-7-19)10-12-20-24(28)21-14-18(23(27)25(29)30)11-13-22(21)33-26(20)31/h3-7,11,13-14,16-17,31H,8-10,12,15H2,1-2H3,(H,29,30)