N-(3-pyridin-2-ylpropyl)-6-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: N-(3-pyridin-2-ylpropyl)-6-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyridin-1-ium-3-carboxamide Openeye Name: N-[3-(2-pyridyl)propyl]-6-[(2S)-2-(2-pyridyl)pyrrolidin-1-yl]pyridin-1-ium-3-carboxamide CAS Name: N-[3-(2-pyridinyl)propyl]-6-[(2S)-2-(2-pyridinyl)-1-pyrrolidinyl]-3-pyridin-1-iumcarboxamide IUPAC Name: N-(3-pyridin-2-ylpropyl)-6-[(2S)-2-pyridin-2-ylpyrrolidin-1-yl]pyridin-1-ium-3-carboxamide Traditional Name: N-[3-(2-pyridyl)propyl]-6-[(2S)-2-(2-pyridyl)pyrrolidino]pyridin-1-ium-3-carboxamide Formula: C23H26N5O+ MolecularWeight: 388.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=[NH+]C=C(C=C2)C(=O)NCCCC3=CC=CC=N3)C4=CC=CC=N4

Isomeric SMILES

C1C[C@H](N(C1)C2=[NH+]C=C(C=C2)C(=O)NCCCC3=CC=CC=N3)C4=CC=CC=N4

InChI

InChI=1S/C23H25N5O/c29-23(26-15-5-8-19-7-1-3-13-24-19)18-11-12-22(27-17-18)28-16-6-10-21(28)20-9-2-4-14-25-20/h1-4,7,9,11-14,17,21H,5-6,8,10,15-16H2,(H,26,29)/p+1/t21-/m0/s1