2-(4-azanylbutanoylamino)-3-(1-methylimidazol-4-yl)propanoic acid

Systemtic Name: 2-(4-azanylbutanoylamino)-3-(1-methylimidazol-4-yl)propanoic acid Openeye Name: 2-(4-aminobutanoylamino)-3-(1-methylimidazol-4-yl)propanoic acid CAS Name: 2-[(4-amino-1-oxobutyl)amino]-3-(1-methyl-4-imidazolyl)propanoic acid IUPAC Name: 2-(4-aminobutanoylamino)-3-(1-methylimidazol-4-yl)propanoic acid Traditional Name: 2-(4-aminobutanoylamino)-3-(1-methylimidazol-4-yl)propionic acid Formula: C11H18N4O3 MolecularWeight: 254.28562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CC(C(=O)O)NC(=O)CCCN

Isomeric SMILES

CN1C=C(N=C1)CC(C(=O)O)NC(=O)CCCN

InChI

InChI=1S/C11H18N4O3/c1-15-6-8(13-7-15)5-9(11(17)18)14-10(16)3-2-4-12/h6-7,9H,2-5,12H2,1H3,(H,14,16)(H,17,18)