N-(cyclopropylcarbamoyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(cyclopropylcarbamoyl)-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[(cyclopropylamino)-oxomethyl]acetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-(cyclopropylcarbamoyl)acetamide Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC(=O)NC3CC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CC[NH+](CC2)CC(=O)NC(=O)NC3CC3

InChI

InChI=1S/C18H24N4O3/c1-13(23)14-2-6-16(7-3-14)22-10-8-21(9-11-22)12-17(24)20-18(25)19-15-4-5-15/h2-3,6-7,15H,4-5,8-12H2,1H3,(H2,19,20,24,25)/p+1