(3S)-2-oxidanylidene-1-phenyl-N-(2-piperidin-1-ium-1-ylethyl)pyrrolidine-3-carboxamide

Systemtic Name: (3S)-2-oxidanylidene-1-phenyl-N-(2-piperidin-1-ium-1-ylethyl)pyrrolidine-3-carboxamide Openeye Name: (3S)-2-oxo-1-phenyl-N-(2-piperidin-1-ium-1-ylethyl)pyrrolidine-3-carboxamide CAS Name: (3S)-2-oxo-1-phenyl-N-[2-(1-piperidin-1-iumyl)ethyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-2-oxo-1-phenyl-N-(2-piperidin-1-ium-1-ylethyl)pyrrolidine-3-carboxamide Traditional Name: (3S)-2-keto-1-phenyl-N-(2-piperidin-1-ium-1-ylethyl)pyrrolidine-3-carboxamide Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC(=O)C2CCN(C2=O)C3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CCNC(=O)[C@@H]2CCN(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C18H25N3O2/c22-17(19-10-14-20-11-5-2-6-12-20)16-9-13-21(18(16)23)15-7-3-1-4-8-15/h1,3-4,7-8,16H,2,5-6,9-14H2,(H,19,22)/p+1/t16-/m0/s1