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4-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)heptoxy]benzoic acid

4-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)heptoxy]benzoic acid

Systemtic Name:4-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)heptoxy]benzoic acid
Openeye Name:4-[2-(2,2,4,4-tetramethylchroman-6-yl)heptoxy]benzoic acid
CAS Name:4-[2-(2,2,4,4-tetramethyl-3,4-dihydro-2H-1-benzopyran-6-yl)heptoxy]benzoic acid
IUPAC Name:4-[2-(2,2,4,4-tetramethyl-3H-chromen-6-yl)heptoxy]benzoic acid
Traditional Name:4-[2-(2,2,4,4-tetramethylchroman-6-yl)heptoxy]benzoic acid
Formula: C27H36O4
MolecularWeight: 424.57234
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(COC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)OC(CC3(C)C)(C)C


Isomeric SMILES

CCCCCC(COC1=CC=C(C=C1)C(=O)O)C2=CC3=C(C=C2)OC(CC3(C)C)(C)C


InChI

InChI=1S/C27H36O4/c1-6-7-8-9-21(17-30-22-13-10-19(11-14-22)25(28)29)20-12-15-24-23(16-20)26(2,3)18-27(4,5)31-24/h10-16,21H,6-9,17-18H2,1-5H3,(H,28,29)


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