2-[4-[7-acetyloxy-3-ethanoyl-3-[(2-methylpropan-2-yl)oxycarbonyl]dodecyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[7-acetyloxy-3-ethanoyl-3-[(2-methylpropan-2-yl)oxycarbonyl]dodecyl]phenyl]ethanoic acid Openeye Name: 2-[4-(7-acetoxy-3-acetyl-3-tert-butoxycarbonyl-dodecyl)phenyl]acetic acid CAS Name: 2-[4-[3-acetyl-7-acetyloxy-3-[(2-methylpropan-2-yl)oxy-oxomethyl]dodecyl]phenyl]acetic acid IUPAC Name: 2-[4-[3-acetyl-7-acetyloxy-3-[(2-methylpropan-2-yl)oxycarbonyl]dodecyl]phenyl]acetic acid Traditional Name: 2-[4-(7-acetoxy-3-acetyl-3-tert-butoxycarbonyl-dodecyl)phenyl]acetic acid Formula: C29H44O7 MolecularWeight: 504.65546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCC1=CC=C(C=C1)CC(=O)O)(C(=O)C)C(=O)OC(C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCC(CCCC(CCC1=CC=C(C=C1)CC(=O)O)(C(=O)C)C(=O)OC(C)(C)C)OC(=O)C

InChI

InChI=1S/C29H44O7/c1-7-8-9-11-25(35-22(3)31)12-10-18-29(21(2)30,27(34)36-28(4,5)6)19-17-23-13-15-24(16-14-23)20-26(32)33/h13-16,25H,7-12,17-20H2,1-6H3,(H,32,33)