(2S)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-[2-(3-pyridyloxy)phenyl]pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-N-[2-(3-pyridinyloxy)phenyl]-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-N-(2-pyridin-3-yloxyphenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-[2-(3-pyridyloxy)phenyl]pyrrolidin-1-ium-2-carboxamide Formula: C23H28N5O2+ MolecularWeight: 406.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C[NH+]2CCCC2C(=O)NC3=CC=CC=C3OC4=CN=CC=C4

Isomeric SMILES

CCN1C=C(C(=N1)C)C[NH+]2CCC[C@H]2C(=O)NC3=CC=CC=C3OC4=CN=CC=C4

InChI

InChI=1S/C23H27N5O2/c1-3-28-16-18(17(2)26-28)15-27-13-7-10-21(27)23(29)25-20-9-4-5-11-22(20)30-19-8-6-12-24-14-19/h4-6,8-9,11-12,14,16,21H,3,7,10,13,15H2,1-2H3,(H,25,29)/p+1/t21-/m0/s1