N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(2-methoxy-5-methyl-phenyl)ethanediamide

Systemtic Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(2-methoxy-5-methyl-phenyl)ethanediamide Openeye Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(2-methoxy-5-methyl-phenyl)oxamide CAS Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-N'-(2-methoxy-5-methylphenyl)oxamide IUPAC Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-N'-(2-methoxy-5-methylphenyl)oxamide Traditional Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N'-(2-methoxy-5-methyl-phenyl)oxamide Formula: C24H33N4O3+ MolecularWeight: 425.54382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NCC(C2=CC=C(C=C2)N(C)C)[NH+]3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C(=O)NC[C@H](C2=CC=C(C=C2)N(C)C)[NH+]3CCCC3

InChI

InChI=1S/C24H32N4O3/c1-17-7-12-22(31-4)20(15-17)26-24(30)23(29)25-16-21(28-13-5-6-14-28)18-8-10-19(11-9-18)27(2)3/h7-12,15,21H,5-6,13-14,16H2,1-4H3,(H,25,29)(H,26,30)/p+1/t21-/m1/s1