N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C26H35N2O4+ MolecularWeight: 439.5671

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COCCO1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

CN(C[C@H]1COCCO1)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C26H34N2O4/c1-27(19-25-20-30-17-18-31-25)26(29)22-7-9-23(10-8-22)32-24-12-15-28(16-13-24)14-11-21-5-3-2-4-6-21/h2-10,24-25H,11-20H2,1H3/p+1/t25-/m0/s1