octyl (2S)-2-azanyl-4-[bis(azanyl)methylideneamino]oxy-butanoate

Systemtic Name: octyl (2S)-2-azanyl-4-[bis(azanyl)methylideneamino]oxy-butanoate Openeye Name: octyl (2S)-2-amino-4-guanidinooxy-butanoate CAS Name: (2S)-2-amino-4-(diaminomethylideneamino)oxybutanoic acid octyl ester IUPAC Name: octyl (2S)-2-amino-4-(diaminomethylideneamino)oxybutanoate Traditional Name: (2S)-2-amino-4-guanidinooxy-butyric acid octyl ester Formula: C13H28N4O3 MolecularWeight: 288.38642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C(CCON=C(N)N)N

Isomeric SMILES

CCCCCCCCOC(=O)[C@H](CCON=C(N)N)N

InChI

InChI=1S/C13H28N4O3/c1-2-3-4-5-6-7-9-19-12(18)11(14)8-10-20-17-13(15)16/h11H,2-10,14H2,1H3,(H4,15,16,17)/t11-/m0/s1