N-[[(3S)-1,3-dimethylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[[(3S)-1,3-dimethylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[[(3S)-1,3-dimethylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[[(3S)-1,3-dimethyl-3-pyrrolidin-1-iumyl]methyl]-N-methyl-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[[(3S)-1,3-dimethylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[[(3S)-1,3-dimethylpyrrolidin-1-ium-3-yl]methyl]-N-methyl-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C28H41N3O2+2 MolecularWeight: 451.64404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[NH+](C1)C)CN(C)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

C[C@]1(CC[NH+](C1)C)CN(C)C(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O2/c1-28(16-20-29(2)21-28)22-30(3)27(32)24-9-11-25(12-10-24)33-26-14-18-31(19-15-26)17-13-23-7-5-4-6-8-23/h4-12,26H,13-22H2,1-3H3/p+2/t28-/m1/s1