N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-imidazole-4-carboxamide CAS Name: N-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]-3-phenylimidazole-4-carboxamide Traditional Name: N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]-3-phenyl-imidazole-4-carboxamide Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CN=CN2C3=CC=CC=C3)[NH+]4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CN=CN2C3=CC=CC=C3)[NH+]4CCCCC4

InChI

InChI=1S/C24H28N4O2/c1-30-21-12-10-19(11-13-21)22(27-14-6-3-7-15-27)17-26-24(29)23-16-25-18-28(23)20-8-4-2-5-9-20/h2,4-5,8-13,16,18,22H,3,6-7,14-15,17H2,1H3,(H,26,29)/p+1/t22-/m0/s1