2-[2-(2-methylbutanoyloxy)naphthalen-1-yl]heptanoic acid

Systemtic Name: 2-[2-(2-methylbutanoyloxy)naphthalen-1-yl]heptanoic acid Openeye Name: 2-[2-(2-methylbutanoyloxy)-1-naphthyl]heptanoic acid CAS Name: 2-[2-(2-methyl-1-oxobutoxy)-1-naphthalenyl]heptanoic acid IUPAC Name: 2-[2-(2-methylbutanoyloxy)naphthalen-1-yl]heptanoic acid Traditional Name: 2-[2-(2-methylbutanoyloxy)-1-naphthyl]enanthic acid Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C=CC2=CC=CC=C21)OC(=O)C(C)CC)C(=O)O

Isomeric SMILES

CCCCCC(C1=C(C=CC2=CC=CC=C21)OC(=O)C(C)CC)C(=O)O

InChI

InChI=1S/C22H28O4/c1-4-6-7-12-18(21(23)24)20-17-11-9-8-10-16(17)13-14-19(20)26-22(25)15(3)5-2/h8-11,13-15,18H,4-7,12H2,1-3H3,(H,23,24)