3,4-dimethoxy-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]benzamide Openeye Name: 3,4-dimethoxy-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]benzamide CAS Name: 3,4-dimethoxy-N-[(3R)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidin-1-iumyl]benzamide IUPAC Name: 3,4-dimethoxy-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]benzamide Traditional Name: 3,4-dimethoxy-N-[(3R)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]benzamide Formula: C20H33N3O3+2 MolecularWeight: 363.49432

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCCC(C2)NC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC[C@H](C2)NC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H31N3O3/c1-22-11-8-17(9-12-22)23-10-4-5-16(14-23)21-20(24)15-6-7-18(25-2)19(13-15)26-3/h6-7,13,16-17H,4-5,8-12,14H2,1-3H3,(H,21,24)/p+2/t16-/m1/s1