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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CNC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CNC(=O)C2=CC=CC=C2)CC3=CC=C(C=C3)Cl

InChI

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