propyl (2S)-6-azanyl-2-[dodecanoyl(octanoyl)amino]hexanoate

Systemtic Name: propyl (2S)-6-azanyl-2-[dodecanoyl(octanoyl)amino]hexanoate Openeye Name: propyl (2S)-6-amino-2-[dodecanoyl(octanoyl)amino]hexanoate CAS Name: (2S)-6-amino-2-[1-oxododecyl(1-oxooctyl)amino]hexanoic acid propyl ester IUPAC Name: propyl (2S)-6-amino-2-[dodecanoyl(octanoyl)amino]hexanoate Traditional Name: (2S)-6-amino-2-[caprylyl(lauroyl)amino]hexanoic acid propyl ester Formula: C29H56N2O4 MolecularWeight: 496.76594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N(C(CCCCN)C(=O)OCCC)C(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCC(=O)N([C@@H](CCCCN)C(=O)OCCC)C(=O)CCCCCCC

InChI

InChI=1S/C29H56N2O4/c1-4-7-9-11-12-13-14-16-18-23-28(33)31(27(32)22-17-15-10-8-5-2)26(21-19-20-24-30)29(34)35-25-6-3/h26H,4-25,30H2,1-3H3/t26-/m0/s1