hexadecyl (2S)-5-[bis(azanyl)methylideneamino]-2-(dodecanoylamino)pentanoate

Systemtic Name: hexadecyl (2S)-5-[bis(azanyl)methylideneamino]-2-(dodecanoylamino)pentanoate Openeye Name: hexadecyl (2S)-2-(dodecanoylamino)-5-guanidino-pentanoate CAS Name: (2S)-5-(diaminomethylideneamino)-2-(1-oxododecylamino)pentanoic acid hexadecyl ester IUPAC Name: hexadecyl (2S)-5-(diaminomethylideneamino)-2-(dodecanoylamino)pentanoate Traditional Name: (2S)-5-guanidino-2-(lauroylamino)valeric acid cetyl ester Formula: C34H68N4O3 MolecularWeight: 580.92872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C(CCCN=C(N)N)NC(=O)CCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)[C@H](CCCN=C(N)N)NC(=O)CCCCCCCCCCC

InChI

InChI=1S/C34H68N4O3/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-30-41-33(40)31(27-26-29-37-34(35)36)38-32(39)28-24-22-20-18-12-10-8-6-4-2/h31H,3-30H2,1-2H3,(H,38,39)(H4,35,36,37)/t31-/m0/s1