2-chloranyl-N-[1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 2-chloranyl-N-[1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[2-(benzylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2-chloro-benzamide CAS Name: 2-chloro-N-[1-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: N-[1-[2-(benzylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-2-chlorobenzamide Traditional Name: N-[1-[2-(benzylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-2-chloro-benzamide Formula: C21H25ClN3O2+ MolecularWeight: 386.8951

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2Cl)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2Cl)CC(=O)NCC3=CC=CC=C3

InChI

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