methyl (2S)-2-azanyl-3-(4-bromanyl-1H-imidazol-5-yl)propanoate

Systemtic Name: methyl (2S)-2-azanyl-3-(4-bromanyl-1H-imidazol-5-yl)propanoate Openeye Name: methyl (2S)-2-amino-3-(4-bromo-1H-imidazol-5-yl)propanoate CAS Name: (2S)-2-amino-3-(4-bromo-1H-imidazol-5-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-3-(4-bromo-1H-imidazol-5-yl)propanoate Traditional Name: (2S)-2-amino-3-(4-bromo-1H-imidazol-5-yl)propionic acid methyl ester Formula: C7H10BrN3O2 MolecularWeight: 248.0772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=C(N=CN1)Br)N

Isomeric SMILES

COC(=O)[C@H](CC1=C(N=CN1)Br)N

InChI

InChI=1S/C7H10BrN3O2/c1-13-7(12)4(9)2-5-6(8)11-3-10-5/h3-4H,2,9H2,1H3,(H,10,11)/t4-/m0/s1