[2-[(2S)-2-acetamido-4-azanyl-4-oxidanylidene-butanoyl]oxy-3-dodecanoyloxy-propyl] dodecanoate

Systemtic Name: [2-[(2S)-2-acetamido-4-azanyl-4-oxidanylidene-butanoyl]oxy-3-dodecanoyloxy-propyl] dodecanoate Openeye Name: [2-[(2S)-2-acetamido-4-amino-4-oxo-butanoyl]oxy-3-dodecanoyloxy-propyl] dodecanoate CAS Name: dodecanoic acid [2-[(2S)-2-acetamido-4-amino-1,4-dioxobutoxy]-3-(1-oxododecoxy)propyl] ester IUPAC Name: [2-[(2S)-2-acetamido-4-amino-4-oxobutanoyl]oxy-3-dodecanoyloxypropyl] dodecanoate Traditional Name: lauric acid [2-[(2S)-2-acetamido-4-amino-4-keto-butanoyl]oxy-3-lauroyloxy-propyl] ester Formula: C33H60N2O8 MolecularWeight: 612.8381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)C(CC(=O)N)NC(=O)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)[C@H](CC(=O)N)NC(=O)C

InChI

InChI=1S/C33H60N2O8/c1-4-6-8-10-12-14-16-18-20-22-31(38)41-25-28(43-33(40)29(24-30(34)37)35-27(3)36)26-42-32(39)23-21-19-17-15-13-11-9-7-5-2/h28-29H,4-26H2,1-3H3,(H2,34,37)(H,35,36)/t29-/m0/s1