methyl (2R)-2-(4-azanylimidazol-1-yl)octanoate

Systemtic Name: methyl (2R)-2-(4-azanylimidazol-1-yl)octanoate Openeye Name: methyl (2R)-2-(4-aminoimidazol-1-yl)octanoate CAS Name: (2R)-2-(4-amino-1-imidazolyl)octanoic acid methyl ester IUPAC Name: methyl (2R)-2-(4-aminoimidazol-1-yl)octanoate Traditional Name: (2R)-2-(4-aminoimidazol-1-yl)caprylic acid methyl ester Formula: C12H21N3O2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)OC)N1C=C(N=C1)N

Isomeric SMILES

CCCCCC[C@H](C(=O)OC)N1C=C(N=C1)N

InChI

InChI=1S/C12H21N3O2/c1-3-4-5-6-7-10(12(16)17-2)15-8-11(13)14-9-15/h8-10H,3-7,13H2,1-2H3/t10-/m1/s1