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3-[(2R)-1-oxidanyl-4-phenyl-butan-2-yl]-1H-imidazol-3-ium-5-carboxamide

3-[(2R)-1-oxidanyl-4-phenyl-butan-2-yl]-1H-imidazol-3-ium-5-carboxamide

Systemtic Name:3-[(2R)-1-oxidanyl-4-phenyl-butan-2-yl]-1H-imidazol-3-ium-5-carboxamide
Openeye Name:3-[(1R)-1-(hydroxymethyl)-3-phenyl-propyl]-1H-imidazol-3-ium-5-carboxamide
CAS Name:3-[(2R)-1-hydroxy-4-phenylbutan-2-yl]-1H-imidazol-3-ium-5-carboxamide
IUPAC Name:3-[(2R)-1-hydroxy-4-phenylbutan-2-yl]-1H-imidazol-3-ium-5-carboxamide
Traditional Name:3-[(1R)-1-methylol-3-phenyl-propyl]-1H-imidazol-3-ium-5-carboxamide
Formula: C14H18N3O2+
MolecularWeight: 260.31162
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(CO)[N+]2=CNC(=C2)C(=O)N


Isomeric SMILES

C1=CC=C(C=C1)CC[C@H](CO)[N+]2=CNC(=C2)C(=O)N


InChI

InChI=1S/C14H17N3O2/c15-14(19)13-8-17(10-16-13)12(9-18)7-6-11-4-2-1-3-5-11/h1-5,8,10,12,18H,6-7,9H2,(H2,15,19)/p+1/t12-/m1/s1


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