N-[1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[1-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-2,2-dimethyl-propanamide Openeye Name: N-[1-[2-(4-chloroanilino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-2,2-dimethyl-propanamide CAS Name: N-[1-[2-(4-chloroanilino)-2-oxoethyl]-4-piperidin-1-iumyl]-2,2-dimethylpropanamide IUPAC Name: N-[1-[2-(4-chloroanilino)-2-oxoethyl]piperidin-1-ium-4-yl]-2,2-dimethylpropanamide Traditional Name: N-[1-[2-(4-chloroanilino)-2-keto-ethyl]piperidin-1-ium-4-yl]-2,2-dimethyl-propionamide Formula: C18H27ClN3O2+ MolecularWeight: 352.87888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H26ClN3O2/c1-18(2,3)17(24)21-15-8-10-22(11-9-15)12-16(23)20-14-6-4-13(19)5-7-14/h4-7,15H,8-12H2,1-3H3,(H,20,23)(H,21,24)/p+1