(2S)-1-[(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)carbonyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[(2-piperidin-1-ium-1-yl-1,3-dihydroinden-2-yl)carbonyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-(2-piperidin-1-ium-1-ylindane-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-1-[oxo-[2-(1-piperidin-1-iumyl)-1,3-dihydroinden-2-yl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-(2-piperidin-1-ium-1-yl-1,3-dihydroindene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-1-(2-piperidin-1-ium-1-ylindane-2-carbonyl)pyrrolidine-2-carboxamide Formula: C20H28N3O2+ MolecularWeight: 342.45522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N4CCCC4C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CC3=CC=CC=C3C2)C(=O)N4CCC[C@H]4C(=O)N

InChI

InChI=1S/C20H27N3O2/c21-18(24)17-9-6-12-23(17)19(25)20(22-10-4-1-5-11-22)13-15-7-2-3-8-16(15)14-20/h2-3,7-8,17H,1,4-6,9-14H2,(H2,21,24)/p+1/t17-/m0/s1