N-methyl-N-[[(2R)-oxan-2-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-methyl-N-[[(2R)-oxan-2-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-[[(2R)-tetrahydropyran-2-yl]methyl]benzamide CAS Name: N-methyl-N-[[(2R)-2-oxanyl]methyl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-methyl-N-[[(2R)-oxan-2-yl]methyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-N-[[(2R)-tetrahydropyran-2-yl]methyl]benzamide Formula: C27H37N2O3+ MolecularWeight: 437.59428

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CCCCO1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CN(C[C@H]1CCCCO1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H36N2O3/c1-28(21-26-9-5-6-20-31-26)27(30)23-10-12-24(13-11-23)32-25-15-18-29(19-16-25)17-14-22-7-3-2-4-8-22/h2-4,7-8,10-13,25-26H,5-6,9,14-21H2,1H3/p+1/t26-/m1/s1