2-(7-acetyloxycarbonyl-5,9-diethyl-tridecan-7-yl)-2-(2-ethylhexoxy)butanedioic acid

Systemtic Name: 2-(7-acetyloxycarbonyl-5,9-diethyl-tridecan-7-yl)-2-(2-ethylhexoxy)butanedioic acid Openeye Name: 2-[1-acetoxycarbonyl-3-ethyl-1-(2-ethylhexyl)heptyl]-2-(2-ethylhexoxy)butanedioic acid CAS Name: 2-[7-[acetyloxy(oxo)methyl]-5,9-diethyltridecan-7-yl]-2-(2-ethylhexoxy)butanedioic acid IUPAC Name: 2-(7-acetyloxycarbonyl-5,9-diethyltridecan-7-yl)-2-(2-ethylhexoxy)butanedioic acid Traditional Name: 2-[1-acetoxycarbonyl-3-ethyl-1-(2-ethylhexyl)heptyl]-2-(2-ethylhexoxy)succinic acid Formula: C32H58O8 MolecularWeight: 570.79812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CC(CC)CCCC)(C(=O)OC(=O)C)C(CC(=O)O)(C(=O)O)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)CC(CC(CC)CCCC)(C(=O)OC(=O)C)C(CC(=O)O)(C(=O)O)OCC(CC)CCCC

InChI

InChI=1S/C32H58O8/c1-8-14-17-25(11-4)20-31(30(38)40-24(7)33,21-26(12-5)18-15-9-2)32(29(36)37,22-28(34)35)39-23-27(13-6)19-16-10-3/h25-27H,8-23H2,1-7H3,(H,34,35)(H,36,37)