(3S)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide CAS Name: (3S)-N-(2-imidazo[1,2-a]pyridinylmethyl)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-(imidazo[1,2-a]pyridin-2-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)nipecotamide Formula: C20H30N5O+ MolecularWeight: 356.4851

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N2CCCC(C2)C(=O)NCC3=CN4C=CC=CC4=N3

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC[C@@H](C2)C(=O)NCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C20H29N5O/c1-23-11-7-18(8-12-23)24-10-4-5-16(14-24)20(26)21-13-17-15-25-9-3-2-6-19(25)22-17/h2-3,6,9,15-16,18H,4-5,7-8,10-14H2,1H3,(H,21,26)/p+1/t16-/m0/s1