[1-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [1-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone Openeye Name: [1-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone CAS Name: [1-[(5,6-dimethyl-1-benzimidazolyl)methyl]-4-piperidin-1-iumyl]-(4-methoxyphenyl)methanone IUPAC Name: [1-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone Traditional Name: [1-[(5,6-dimethylbenzimidazol-1-yl)methyl]piperidin-1-ium-4-yl]-(4-methoxyphenyl)methanone Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)C[NH+]3CCC(CC3)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)C[NH+]3CCC(CC3)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H27N3O2/c1-16-12-21-22(13-17(16)2)26(14-24-21)15-25-10-8-19(9-11-25)23(27)18-4-6-20(28-3)7-5-18/h4-7,12-14,19H,8-11,15H2,1-3H3/p+1