[1-azanyl-7-[bis(azanyl)methylideneamino]-1-oxidanylidene-heptan-3-yl] propanoate

Systemtic Name: [1-azanyl-7-[bis(azanyl)methylideneamino]-1-oxidanylidene-heptan-3-yl] propanoate Openeye Name: [1-(2-amino-2-oxo-ethyl)-5-guanidino-pentyl] propanoate CAS Name: propanoic acid [1-amino-7-(diaminomethylideneamino)-1-oxoheptan-3-yl] ester IUPAC Name: [1-amino-7-(diaminomethylideneamino)-1-oxoheptan-3-yl] propanoate Traditional Name: propionic acid [1-(2-amino-2-keto-ethyl)-5-guanidino-pentyl] ester Formula: C11H22N4O3 MolecularWeight: 258.31738

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(CCCCN=C(N)N)CC(=O)N

Isomeric SMILES

CCC(=O)OC(CCCCN=C(N)N)CC(=O)N

InChI

InChI=1S/C11H22N4O3/c1-2-10(17)18-8(7-9(12)16)5-3-4-6-15-11(13)14/h8H,2-7H2,1H3,(H2,12,16)(H4,13,14,15)