methyl 2-azanyl-3-[1-(3-methylbutyl)imidazol-4-yl]propanoate

Systemtic Name: methyl 2-azanyl-3-[1-(3-methylbutyl)imidazol-4-yl]propanoate Openeye Name: methyl 2-amino-3-(1-isopentylimidazol-4-yl)propanoate CAS Name: 2-amino-3-[1-(3-methylbutyl)-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-[1-(3-methylbutyl)imidazol-4-yl]propanoate Traditional Name: 2-amino-3-(1-isoamylimidazol-4-yl)propionic acid methyl ester Formula: C12H21N3O2 MolecularWeight: 239.31404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(N=C1)CC(C(=O)OC)N

Isomeric SMILES

CC(C)CCN1C=C(N=C1)CC(C(=O)OC)N

InChI

InChI=1S/C12H21N3O2/c1-9(2)4-5-15-7-10(14-8-15)6-11(13)12(16)17-3/h7-9,11H,4-6,13H2,1-3H3