2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-propyl-ethanamide

Systemtic Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-propyl-ethanamide Openeye Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-propyl-acetamide CAS Name: 2-[4-(2-cyanophenyl)sulfonyl-1-piperazin-1-iumyl]-N-(1-cyclopentenyl)-N-propylacetamide IUPAC Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-propylacetamide Traditional Name: 2-[4-(2-cyanophenyl)sulfonylpiperazin-1-ium-1-yl]-N-(cyclopenten-1-yl)-N-propyl-acetamide Formula: C21H29N4O3S+ MolecularWeight: 417.54496

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CCCC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

CCCN(C1=CCCC1)C(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C21H28N4O3S/c1-2-11-25(19-8-4-5-9-19)21(26)17-23-12-14-24(15-13-23)29(27,28)20-10-6-3-7-18(20)16-22/h3,6-8,10H,2,4-5,9,11-15,17H2,1H3/p+1