3-[(3R,4S)-1-naphthalen-1-yl-4-oxidanyl-pentan-3-yl]-1H-imidazol-3-ium-5-carboxamide

Systemtic Name: 3-[(3R,4S)-1-naphthalen-1-yl-4-oxidanyl-pentan-3-yl]-1H-imidazol-3-ium-5-carboxamide Openeye Name: 3-[(1R,2S)-2-hydroxy-1-[2-(1-naphthyl)ethyl]propyl]-1H-imidazol-3-ium-5-carboxamide CAS Name: 3-[(3R,4S)-4-hydroxy-1-(1-naphthalenyl)pentan-3-yl]-1H-imidazol-3-ium-5-carboxamide IUPAC Name: 3-[(3R,4S)-4-hydroxy-1-naphthalen-1-ylpentan-3-yl]-1H-imidazol-3-ium-5-carboxamide Traditional Name: 3-[(1R,2S)-2-hydroxy-1-[2-(1-naphthyl)ethyl]propyl]-1H-imidazol-3-ium-5-carboxamide Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC2=CC=CC=C21)[N+]3=CNC(=C3)C(=O)N)O

Isomeric SMILES

C[C@@H]([C@@H](CCC1=CC=CC2=CC=CC=C21)[N+]3=CNC(=C3)C(=O)N)O

InChI

InChI=1S/C19H21N3O2/c1-13(23)18(22-11-17(19(20)24)21-12-22)10-9-15-7-4-6-14-5-2-3-8-16(14)15/h2-8,11-13,18,23H,9-10H2,1H3,(H2,20,24)/p+1/t13-,18+/m0/s1