(2R)-1-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-[4-(pyrrolidine-1-carbonyl)benzyl]piperidin-1-ium-2-carboxamide Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)N)CC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)N)CC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C18H25N3O2/c19-17(22)16-5-1-2-12-21(16)13-14-6-8-15(9-7-14)18(23)20-10-3-4-11-20/h6-9,16H,1-5,10-13H2,(H2,19,22)/p+1/t16-/m1/s1