6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-methyl-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-methyl-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide Openeye Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-methyl-N-(2-quinolylmethyl)pyridin-1-ium-3-carboxamide CAS Name: 6-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-N-methyl-N-(2-quinolinylmethyl)-3-pyridin-1-iumcarboxamide IUPAC Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-methyl-N-(quinolin-2-ylmethyl)pyridin-1-ium-3-carboxamide Traditional Name: 6-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-N-methyl-N-(2-quinolylmethyl)pyridin-1-ium-3-carboxamide Formula: C24H31N5O+2 MolecularWeight: 405.53584

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC2=[NH+]C=C(C=C2)C(=O)N(C)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC2=[NH+]C=C(C=C2)C(=O)N(C)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H29N5O/c1-3-29-14-6-8-21(29)16-26-23-13-11-19(15-25-23)24(30)28(2)17-20-12-10-18-7-4-5-9-22(18)27-20/h4-5,7,9-13,15,21H,3,6,8,14,16-17H2,1-2H3,(H,25,26)/p+2/t21-/m0/s1