[3-acetamido-4-(4-dodecanoylphenyl)-2-methyl-butyl] ethanoate

Systemtic Name: [3-acetamido-4-(4-dodecanoylphenyl)-2-methyl-butyl] ethanoate Openeye Name: [3-acetamido-4-(4-dodecanoylphenyl)-2-methyl-butyl] acetate CAS Name: acetic acid [3-acetamido-2-methyl-4-[4-(1-oxododecyl)phenyl]butyl] ester IUPAC Name: [3-acetamido-4-(4-dodecanoylphenyl)-2-methylbutyl] acetate Traditional Name: acetic acid [3-acetamido-4-(4-lauroylphenyl)-2-methyl-butyl] ester Formula: C27H43NO4 MolecularWeight: 445.63462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC=C(C=C1)CC(C(C)COC(=O)C)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC=C(C=C1)CC(C(C)COC(=O)C)NC(=O)C

InChI

InChI=1S/C27H43NO4/c1-5-6-7-8-9-10-11-12-13-14-27(31)25-17-15-24(16-18-25)19-26(28-22(3)29)21(2)20-32-23(4)30/h15-18,21,26H,5-14,19-20H2,1-4H3,(H,28,29)