(2S)-2-[(3-azanyl-4-methyl-hexanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: (2S)-2-[(3-azanyl-4-methyl-hexanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2S)-2-[(3-amino-4-methyl-hexanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2S)-2-[(3-amino-4-methyl-1-oxohexyl)amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2S)-2-[(3-amino-4-methylhexanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2S)-2-[(3-amino-4-methyl-hexanoyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C13H22N4O3 MolecularWeight: 282.33878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC(=O)NC(CC1=CN=CN1)C(=O)O)N

Isomeric SMILES

CCC(C)C(CC(=O)N[C@@H](CC1=CN=CN1)C(=O)O)N

InChI

InChI=1S/C13H22N4O3/c1-3-8(2)10(14)5-12(18)17-11(13(19)20)4-9-6-15-7-16-9/h6-8,10-11H,3-5,14H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)/t8?,10?,11-/m0/s1