N-(3-chlorophenyl)-4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3-chlorophenyl)-4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-4-ium-1-carboxamide Openeye Name: N-(3-chlorophenyl)-4-[2-(dimethylamino)-2-oxo-ethyl]piperazin-4-ium-1-carboxamide CAS Name: N-(3-chlorophenyl)-4-[2-(dimethylamino)-2-oxoethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-chlorophenyl)-4-[2-(dimethylamino)-2-oxoethyl]piperazin-4-ium-1-carboxamide Traditional Name: N-(3-chlorophenyl)-4-[2-(dimethylamino)-2-keto-ethyl]piperazin-4-ium-1-carboxamide Formula: C15H22ClN4O2+ MolecularWeight: 325.81378

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CN(C)C(=O)C[NH+]1CCN(CC1)C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C15H21ClN4O2/c1-18(2)14(21)11-19-6-8-20(9-7-19)15(22)17-13-5-3-4-12(16)10-13/h3-5,10H,6-9,11H2,1-2H3,(H,17,22)/p+1