2-[3-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-N-(4-phenoxyphenyl)ethanamide chloride

Systemtic Name: 2-[3-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-N-(4-phenoxyphenyl)ethanamide chloride Openeye Name: N-(4-phenoxyphenyl)-2-[3-(p-tolyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]acetamide chloride CAS Name: 2-[3-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-N-(4-phenoxyphenyl)acetamide chloride IUPAC Name: 2-[3-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl]-N-(4-phenoxyphenyl)acetamide chloride Traditional Name: N-(4-phenoxyphenyl)-2-[3-(p-tolyl)-6,7-dihydro-5H-pyrrol[1,2-a]imidazol-1-ium-1-yl]acetamide chloride Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C[N+](=C3N2CCC3)CC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5.[Cl-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C[N+](=C3N2CCC3)CC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C27H25N3O2.ClH/c1-20-9-11-21(12-10-20)25-18-29(27-8-5-17-30(25)27)19-26(31)28-22-13-15-24(16-14-22)32-23-6-3-2-4-7-23;/h2-4,6-7,9-16,18H,5,8,17,19H2,1H3;1H