N'-(2,2-diethoxyethyl)-N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanediamide

Systemtic Name: N'-(2,2-diethoxyethyl)-N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanediamide Openeye Name: N'-(2,2-diethoxyethyl)-N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]oxamide CAS Name: N'-(2,2-diethoxyethyl)-N-[(2S)-2-(4-dimethylaminophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]oxamide IUPAC Name: N'-(2,2-diethoxyethyl)-N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-ylethyl]oxamide Traditional Name: N'-(2,2-diethoxyethyl)-N-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]oxamide Formula: C22H37N4O4+ MolecularWeight: 421.55358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=O)C(=O)NCC(C1=CC=C(C=C1)N(C)C)[NH+]2CCCC2)OCC

Isomeric SMILES

CCOC(CNC(=O)C(=O)NC[C@H](C1=CC=C(C=C1)N(C)C)[NH+]2CCCC2)OCC

InChI

InChI=1S/C22H36N4O4/c1-5-29-20(30-6-2)16-24-22(28)21(27)23-15-19(26-13-7-8-14-26)17-9-11-18(12-10-17)25(3)4/h9-12,19-20H,5-8,13-16H2,1-4H3,(H,23,27)(H,24,28)/p+1/t19-/m1/s1