2-[4-(4-acetamidophenyl)carbonylpiperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[4-(4-acetamidophenyl)carbonylpiperazin-1-ium-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[4-(4-acetamidobenzoyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[4-[(4-acetamidophenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-cyclopropylacetamide IUPAC Name: 2-[4-(4-acetamidobenzoyl)piperazin-1-ium-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[4-(4-acetamidobenzoyl)piperazin-1-ium-1-yl]-N-cyclopropyl-acetamide Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3CC3

InChI

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