1-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2)CC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3O2/c22-18-8-6-16(7-9-18)14-23-20(26)15-25-12-10-17(11-13-25)21(27)24-19-4-2-1-3-5-19/h1-9,17H,10-15H2,(H,23,26)(H,24,27)/p+1