N-(4-cyanophenyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-cyanophenyl)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-cyanophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-cyanophenyl)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-cyanophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-cyanophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]acetamide Formula: C17H21N4O2+ MolecularWeight: 313.37424

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC1C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H20N4O2/c18-11-13-1-5-15(6-2-13)19-16(22)12-20-7-9-21(10-8-20)17(23)14-3-4-14/h1-2,5-6,14H,3-4,7-10,12H2,(H,19,22)/p+1