2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-[2-(dimethylamino)-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[4-[2-(dimethylamino)-2-oxo-ethyl]piperazin-1-ium-1-yl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]-1-piperazin-1-iumyl]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-ium-1-yl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[4-[2-(dimethylamino)-2-keto-ethyl]piperazin-1-ium-1-yl]-N-(2,3-dimethylphenyl)acetamide Formula: C18H29N4O2+ MolecularWeight: 333.44846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C[NH+]2CCN(CC2)CC(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C[NH+]2CCN(CC2)CC(=O)N(C)C)C

InChI

InChI=1S/C18H28N4O2/c1-14-6-5-7-16(15(14)2)19-17(23)12-21-8-10-22(11-9-21)13-18(24)20(3)4/h5-7H,8-13H2,1-4H3,(H,19,23)/p+1