[3-[[(2S)-2-phenethylpiperidin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridin-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [3-[[(2S)-2-phenethylpiperidin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridin-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [3-[[(2S)-2-phenethylpiperidin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridin-2-yl]-pyrrolidin-1-yl-methanone CAS Name: [3-[[(2S)-2-phenethyl-1-piperidin-1-iumyl]methyl]-2-imidazo[1,2-a]pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [3-[[(2S)-2-phenethylpiperidin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridin-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [3-[[(2S)-2-phenethylpiperidin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridin-2-yl]-pyrrolidino-methanone Formula: C26H33N4O+ MolecularWeight: 417.56642

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CCC2=CC=CC=C2)CC3=C(N=C4N3C=CC=C4)C(=O)N5CCCC5

Isomeric SMILES

C1CC[NH+]([C@@H](C1)CCC2=CC=CC=C2)CC3=C(N=C4N3C=CC=C4)C(=O)N5CCCC5

InChI

InChI=1S/C26H32N4O/c31-26(28-16-8-9-17-28)25-23(30-19-7-5-13-24(30)27-25)20-29-18-6-4-12-22(29)15-14-21-10-2-1-3-11-21/h1-3,5,7,10-11,13,19,22H,4,6,8-9,12,14-18,20H2/p+1/t22-/m0/s1