1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-oxidanylidene-2-(3-phenylpropylamino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-(3-phenylpropylamino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-oxo-2-(3-phenylpropylamino)ethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-oxo-2-(3-phenylpropylamino)ethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-(3-phenylpropylamino)ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NCCCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NCCCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2/c27-22(24-15-7-10-19-8-3-1-4-9-19)18-26-16-13-20(14-17-26)23(28)25-21-11-5-2-6-12-21/h1-6,8-9,11-12,20H,7,10,13-18H2,(H,24,27)(H,25,28)/p+1