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

Systemtic Name: N'-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-ethyl-ethanediamide Openeye Name: N'-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-ethyl-oxamide CAS Name: N'-[(2S)-2-(4-dimethylaminophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-N-ethyloxamide IUPAC Name: N'-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-N-ethyloxamide Traditional Name: N'-[(2S)-2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-ethyl-oxamide Formula: C18H29N4O2+ MolecularWeight: 333.44846

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(=O)NCC(C1=CC=C(C=C1)N(C)C)[NH+]2CCCC2

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O2/c1-4-19-17(23)18(24)20-13-16(22-11-5-6-12-22)14-7-9-15(10-8-14)21(2)3/h7-10,16H,4-6,11-13H2,1-3H3,(H,19,23)(H,20,24)/p+1/t16-/m1/s1