[4-(4-dodecanoylphenyl)-2-methyl-butyl] 2-acetamidoethanoate

Systemtic Name: [4-(4-dodecanoylphenyl)-2-methyl-butyl] 2-acetamidoethanoate Openeye Name: [4-(4-dodecanoylphenyl)-2-methyl-butyl] 2-acetamidoacetate CAS Name: 2-acetamidoacetic acid [2-methyl-4-[4-(1-oxododecyl)phenyl]butyl] ester IUPAC Name: [4-(4-dodecanoylphenyl)-2-methylbutyl] 2-acetamidoacetate Traditional Name: 2-acetamidoacetic acid [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)CCC(C)COC(=O)CNC(=O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC=C(C=C1)CCC(C)COC(=O)CNC(=O)C

InChI

InChI=1S/C27H43NO4/c1-4-5-6-7-8-9-10-11-12-13-26(30)25-18-16-24(17-19-25)15-14-22(2)21-32-27(31)20-28-23(3)29/h16-19,22H,4-15,20-21H2,1-3H3,(H,28,29)