N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-N-methyl-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-N-methyl-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-N-methyl-benzamide CAS Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-N-methyl-3-[(1-propan-2-yl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-N-methyl-3-(1-propan-2-ylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-3-(1-isopropylpiperidin-1-ium-4-yl)oxy-4-methoxy-N-methyl-benzamide Formula: C22H35N2O5+ MolecularWeight: 407.5237

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)N(C)CC3COCCO3)OC

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)N(C)C[C@H]3COCCO3)OC

InChI

InChI=1S/C22H34N2O5/c1-16(2)24-9-7-18(8-10-24)29-21-13-17(5-6-20(21)26-4)22(25)23(3)14-19-15-27-11-12-28-19/h5-6,13,16,18-19H,7-12,14-15H2,1-4H3/p+1/t19-/m0/s1