N-(2,3-dimethylphenyl)-2-(4-prop-2-ynylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-(4-prop-2-ynylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2,3-dimethylphenyl)-2-(4-prop-2-ynylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(2,3-dimethylphenyl)-2-(4-prop-2-ynyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2,3-dimethylphenyl)-2-(4-prop-2-ynylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2,3-dimethylphenyl)-2-(4-propargylpiperazin-1-ium-1-yl)acetamide Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O/c1-4-8-19-9-11-20(12-10-19)13-17(21)18-16-7-5-6-14(2)15(16)3/h1,5-7H,8-13H2,2-3H3,(H,18,21)/p+1