2-(2-azanylethylamino)-3-(1-butylimidazol-4-yl)propanoic acid

Systemtic Name: 2-(2-azanylethylamino)-3-(1-butylimidazol-4-yl)propanoic acid Openeye Name: 2-(2-aminoethylamino)-3-(1-butylimidazol-4-yl)propanoic acid CAS Name: 2-(2-aminoethylamino)-3-(1-butyl-4-imidazolyl)propanoic acid IUPAC Name: 2-(2-aminoethylamino)-3-(1-butylimidazol-4-yl)propanoic acid Traditional Name: 2-(2-aminoethylamino)-3-(1-butylimidazol-4-yl)propionic acid Formula: C12H22N4O2 MolecularWeight: 254.32868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(N=C1)CC(C(=O)O)NCCN

Isomeric SMILES

CCCCN1C=C(N=C1)CC(C(=O)O)NCCN

InChI

InChI=1S/C12H22N4O2/c1-2-3-6-16-8-10(15-9-16)7-11(12(17)18)14-5-4-13/h8-9,11,14H,2-7,13H2,1H3,(H,17,18)