[4-(2-azanyl-3-methyl-butanoyl)oxy-3-methyl-butyl] octadecanoate

Systemtic Name: [4-(2-azanyl-3-methyl-butanoyl)oxy-3-methyl-butyl] octadecanoate Openeye Name: [4-(2-amino-3-methyl-butanoyl)oxy-3-methyl-butyl] octadecanoate CAS Name: octadecanoic acid [4-(2-amino-3-methyl-1-oxobutoxy)-3-methylbutyl] ester IUPAC Name: [4-(2-amino-3-methylbutanoyl)oxy-3-methylbutyl] octadecanoate Traditional Name: stearic acid [4-(2-amino-3-methyl-butanoyl)oxy-3-methyl-butyl] ester Formula: C28H55NO4 MolecularWeight: 469.7406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCC(C)COC(=O)C(C(C)C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCC(C)COC(=O)C(C(C)C)N

InChI

InChI=1S/C28H55NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(30)32-22-21-25(4)23-33-28(31)27(29)24(2)3/h24-25,27H,5-23,29H2,1-4H3