N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-2-(2-phenylimidazol-1-yl)ethanamide

Systemtic Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-2-(2-phenylimidazol-1-yl)ethanamide Openeye Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-2-(2-phenylimidazol-1-yl)acetamide CAS Name: N-[(3S)-1-[(4-chlorophenyl)methyl]-3-piperidin-1-iumyl]-2-(2-phenyl-1-imidazolyl)acetamide IUPAC Name: N-[(3S)-1-[(4-chlorophenyl)methyl]piperidin-1-ium-3-yl]-2-(2-phenylimidazol-1-yl)acetamide Traditional Name: N-[(3S)-1-(4-chlorobenzyl)piperidin-1-ium-3-yl]-2-(2-phenylimidazol-1-yl)acetamide Formula: C23H26ClN4O+ MolecularWeight: 409.93174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=C(C=C2)Cl)NC(=O)CN3C=CN=C3C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)Cl)NC(=O)CN3C=CN=C3C4=CC=CC=C4

InChI

InChI=1S/C23H25ClN4O/c24-20-10-8-18(9-11-20)15-27-13-4-7-21(16-27)26-22(29)17-28-14-12-25-23(28)19-5-2-1-3-6-19/h1-3,5-6,8-12,14,21H,4,7,13,15-17H2,(H,26,29)/p+1/t21-/m0/s1