2-ethoxycarbonyl-2-[1-(4-heptoxyphenyl)ethyl]hexanoic acid

Systemtic Name: 2-ethoxycarbonyl-2-[1-(4-heptoxyphenyl)ethyl]hexanoic acid Openeye Name: 2-ethoxycarbonyl-2-[1-(4-heptoxyphenyl)ethyl]hexanoic acid CAS Name: 2-ethoxycarbonyl-2-[1-(4-heptoxyphenyl)ethyl]hexanoic acid IUPAC Name: 2-ethoxycarbonyl-2-[1-(4-heptoxyphenyl)ethyl]hexanoic acid Traditional Name: 2-carbethoxy-2-[1-(4-heptoxyphenyl)ethyl]hexanoic acid Formula: C24H38O5 MolecularWeight: 406.55552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(C)C(CCCC)(C(=O)O)C(=O)OCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(C)C(CCCC)(C(=O)O)C(=O)OCC

InChI

InChI=1S/C24H38O5/c1-5-8-10-11-12-18-29-21-15-13-20(14-16-21)19(4)24(22(25)26,17-9-6-2)23(27)28-7-3/h13-16,19H,5-12,17-18H2,1-4H3,(H,25,26)