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

Systemtic Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-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-benzamide CAS Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-3-[(1-propan-2-yl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[[(2S)-1,4-dioxan-2-yl]methyl]-4-methoxy-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-benzamide Formula: C21H33N2O5+ MolecularWeight: 393.49712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)OC2=C(C=CC(=C2)C(=O)NCC3COCCO3)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O5/c1-15(2)23-8-6-17(7-9-23)28-20-12-16(4-5-19(20)25-3)21(24)22-13-18-14-26-10-11-27-18/h4-5,12,15,17-18H,6-11,13-14H2,1-3H3,(H,22,24)/p+1/t18-/m0/s1