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

Systemtic Name: (3S)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide Openeye Name: (3S)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide CAS Name: (3S)-N-(3-imidazo[1,2-a]pyridinylmethyl)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(imidazo[1,2-a]pyridin-3-ylmethyl)-1-(1-methylpiperidin-1-ium-4-yl)piperidine-3-carboxamide Traditional Name: (3S)-N-(imidazo[1,2-a]pyridin-3-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=CN=C4N3C=CC=C4

Isomeric SMILES

C[NH+]1CCC(CC1)N2CCC[C@@H](C2)C(=O)NCC3=CN=C4N3C=CC=C4

InChI

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