N-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-oxidanylidene-2-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]amino]ethyl]-2-phenyl-ethanamide Openeye Name: N-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-2-phenyl-acetamide CAS Name: N-[2-oxo-2-[4-(1-pyrrolidin-1-iumylmethyl)anilino]ethyl]-2-phenylacetamide IUPAC Name: N-[2-oxo-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-2-phenylacetamide Traditional Name: N-[2-keto-2-[4-(pyrrolidin-1-ium-1-ylmethyl)anilino]ethyl]-2-phenyl-acetamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)CNC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)NC(=O)CNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c25-20(14-17-6-2-1-3-7-17)22-15-21(26)23-19-10-8-18(9-11-19)16-24-12-4-5-13-24/h1-3,6-11H,4-5,12-16H2,(H,22,25)(H,23,26)/p+1