N-[2-[2-oxidanylidene-3-(phenylmethyl)-3-piperidin-4-yl-imidazol-3-ium-1-yl]phenyl]ethanamide

Systemtic Name: N-[2-[2-oxidanylidene-3-(phenylmethyl)-3-piperidin-4-yl-imidazol-3-ium-1-yl]phenyl]ethanamide Openeye Name: N-[2-[3-benzyl-2-oxo-3-(4-piperidyl)imidazol-3-ium-1-yl]phenyl]acetamide CAS Name: N-[2-[2-oxo-3-(phenylmethyl)-3-(4-piperidinyl)-1-imidazol-3-iumyl]phenyl]acetamide IUPAC Name: N-[2-(3-benzyl-2-oxo-3-piperidin-4-ylimidazol-3-ium-1-yl)phenyl]acetamide Traditional Name: N-[2-[3-benzyl-2-keto-3-(4-piperidyl)-4-imidazolin-3-ium-1-yl]phenyl]acetamide Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1N2C=C[N+](C2=O)(CC3=CC=CC=C3)C4CCNCC4

Isomeric SMILES

CC(=O)NC1=CC=CC=C1N2C=C[N+](C2=O)(CC3=CC=CC=C3)C4CCNCC4

InChI

InChI=1S/C23H26N4O2/c1-18(28)25-21-9-5-6-10-22(21)26-15-16-27(23(26)29,20-11-13-24-14-12-20)17-19-7-3-2-4-8-19/h2-10,15-16,20,24H,11-14,17H2,1H3/p+1