[3-(1-acetamido-2-acetyloxy-3-methyl-butyl)-2-ethyl-6-octyl-phenyl] ethanoate

Systemtic Name: [3-(1-acetamido-2-acetyloxy-3-methyl-butyl)-2-ethyl-6-octyl-phenyl] ethanoate Openeye Name: [3-(1-acetamido-2-acetoxy-3-methyl-butyl)-2-ethyl-6-octyl-phenyl] acetate CAS Name: acetic acid [3-(1-acetamido-2-acetyloxy-3-methylbutyl)-2-ethyl-6-octylphenyl] ester IUPAC Name: [3-(1-acetamido-2-acetyloxy-3-methylbutyl)-2-ethyl-6-octylphenyl] acetate Traditional Name: acetic acid [3-(1-acetamido-2-acetoxy-3-methyl-butyl)-2-ethyl-6-octyl-phenyl] ester Formula: C27H43NO5 MolecularWeight: 461.63402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=C(C=C1)C(C(C(C)C)OC(=O)C)NC(=O)C)CC)OC(=O)C

Isomeric SMILES

CCCCCCCCC1=C(C(=C(C=C1)C(C(C(C)C)OC(=O)C)NC(=O)C)CC)OC(=O)C

InChI

InChI=1S/C27H43NO5/c1-8-10-11-12-13-14-15-22-16-17-24(23(9-2)27(22)33-21(7)31)25(28-19(5)29)26(18(3)4)32-20(6)30/h16-18,25-26H,8-15H2,1-7H3,(H,28,29)