N-[2-[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]ethyl]oxane-4-carboxamide

Systemtic Name: N-[2-[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]ethyl]oxane-4-carboxamide Openeye Name: N-[2-(3-benzyl-1H-imidazol-3-ium-2-yl)ethyl]tetrahydropyran-4-carboxamide CAS Name: N-[2-[3-(phenylmethyl)-1H-imidazol-3-ium-2-yl]ethyl]-4-oxanecarboxamide IUPAC Name: N-[2-(3-benzyl-1H-imidazol-3-ium-2-yl)ethyl]oxane-4-carboxamide Traditional Name: N-[2-(3-benzyl-1H-imidazol-3-ium-2-yl)ethyl]tetrahydropyran-4-carboxamide Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1C(=O)NCCC2=[N+](C=CN2)CC3=CC=CC=C3

Isomeric SMILES

C1COCCC1C(=O)NCCC2=[N+](C=CN2)CC3=CC=CC=C3

InChI

InChI=1S/C18H23N3O2/c22-18(16-7-12-23-13-8-16)20-9-6-17-19-10-11-21(17)14-15-4-2-1-3-5-15/h1-5,10-11,16H,6-9,12-14H2,(H,20,22)/p+1