4-imidazol-1-yl-N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]benzamide

Systemtic Name: 4-imidazol-1-yl-N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]benzamide Openeye Name: 4-imidazol-1-yl-N-methyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]benzamide CAS Name: 4-(1-imidazolyl)-N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]-3-piperidin-1-iumyl]methyl]benzamide IUPAC Name: 4-imidazol-1-yl-N-methyl-N-[[(3R)-1-[2-(2-methylphenyl)ethyl]piperidin-1-ium-3-yl]methyl]benzamide Traditional Name: 4-imidazol-1-yl-N-methyl-N-[[(3R)-1-[2-(o-tolyl)ethyl]piperidin-1-ium-3-yl]methyl]benzamide Formula: C26H33N4O+ MolecularWeight: 417.56642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC[NH+]2CCCC(C2)CN(C)C(=O)C3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=CC=CC=C1CC[NH+]2CCC[C@@H](C2)CN(C)C(=O)C3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C26H32N4O/c1-21-6-3-4-8-23(21)13-16-29-15-5-7-22(19-29)18-28(2)26(31)24-9-11-25(12-10-24)30-17-14-27-20-30/h3-4,6,8-12,14,17,20,22H,5,7,13,15-16,18-19H2,1-2H3/p+1/t22-/m1/s1