tetradecyl (2S)-5-[bis(azanyl)methylideneamino]-2-(octanoylamino)pentanoate

Systemtic Name: tetradecyl (2S)-5-[bis(azanyl)methylideneamino]-2-(octanoylamino)pentanoate Openeye Name: tetradecyl (2S)-5-guanidino-2-(octanoylamino)pentanoate CAS Name: (2S)-5-(diaminomethylideneamino)-2-(1-oxooctylamino)pentanoic acid tetradecyl ester IUPAC Name: tetradecyl (2S)-5-(diaminomethylideneamino)-2-(octanoylamino)pentanoate Traditional Name: (2S)-2-(caprylylamino)-5-guanidino-valeric acid myristyl ester Formula: C28H56N4O3 MolecularWeight: 496.76924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(=O)C(CCCN=C(N)N)NC(=O)CCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCOC(=O)[C@H](CCCN=C(N)N)NC(=O)CCCCCCC

InChI

InChI=1S/C28H56N4O3/c1-3-5-7-9-10-11-12-13-14-15-17-19-24-35-27(34)25(21-20-23-31-28(29)30)32-26(33)22-18-16-8-6-4-2/h25H,3-24H2,1-2H3,(H,32,33)(H4,29,30,31)/t25-/m0/s1