1-[3-oxidanylidene-3-[(2-phenylphenyl)amino]propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-oxidanylidene-3-[(2-phenylphenyl)amino]propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-1-[3-oxo-3-(2-phenylanilino)propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[3-oxo-3-(2-phenylanilino)propyl]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[3-oxo-3-(2-phenylanilino)propyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[3-keto-3-(2-phenylanilino)propyl]piperidin-1-ium-4-carboxamide Formula: C28H32N3O2+ MolecularWeight: 442.57258

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)CCC(=O)NC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=CC=CC=C2)CCC(=O)NC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C28H31N3O2/c32-27(30-26-14-8-7-13-25(26)23-11-5-2-6-12-23)17-20-31-18-15-24(16-19-31)28(33)29-21-22-9-3-1-4-10-22/h1-14,24H,15-21H2,(H,29,33)(H,30,32)/p+1