N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-methoxy-4-(1-methylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-methoxy-4-(1-methylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-methoxy-4-(1-methylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-3-methoxy-4-[(1-methyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-methoxy-4-(1-methylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-3-methoxy-4-(1-methylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C21H35N3O3+2 MolecularWeight: 377.5209

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=CC(=C(C=C2)OC3CC[NH+](CC3)C)OC

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=CC(=C(C=C2)OC3CC[NH+](CC3)C)OC

InChI

InChI=1S/C21H33N3O3/c1-4-24-11-5-6-17(24)15-22-21(25)16-7-8-19(20(14-16)26-3)27-18-9-12-23(2)13-10-18/h7-8,14,17-18H,4-6,9-13,15H2,1-3H3,(H,22,25)/p+2/t17-/m0/s1