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

Systemtic Name: propyl (2S)-5-[bis(azanyl)methylideneamino]-2-(dodecanoylamino)pentanoate Openeye Name: propyl (2S)-2-(dodecanoylamino)-5-guanidino-pentanoate CAS Name: (2S)-5-(diaminomethylideneamino)-2-(1-oxododecylamino)pentanoic acid propyl ester IUPAC Name: propyl (2S)-5-(diaminomethylideneamino)-2-(dodecanoylamino)pentanoate Traditional Name: (2S)-5-guanidino-2-(lauroylamino)valeric acid propyl ester Formula: C21H42N4O3 MolecularWeight: 398.58318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC(CCCN=C(N)N)C(=O)OCCC

Isomeric SMILES

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

InChI

InChI=1S/C21H42N4O3/c1-3-5-6-7-8-9-10-11-12-15-19(26)25-18(20(27)28-17-4-2)14-13-16-24-21(22)23/h18H,3-17H2,1-2H3,(H,25,26)(H4,22,23,24)/t18-/m0/s1