1-[2-oxidanylidene-2-[phenyl-(phenylmethyl)amino]ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-[phenyl-(phenylmethyl)amino]ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(N-benzylanilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-(N-(phenylmethyl)anilino)ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(N-benzylanilino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(N-benzylanilino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c22-21(26)18-11-13-23(14-12-18)16-20(25)24(19-9-5-2-6-10-19)15-17-7-3-1-4-8-17/h1-10,18H,11-16H2,(H2,22,26)/p+1