2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-ethanamide

Systemtic Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-ethanamide Openeye Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-acetamide CAS Name: 2-[4-(2-nitrophenyl)sulfonyl-1-piperazin-1-iumyl]-N,N-dipropylacetamide IUPAC Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropylacetamide Traditional Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-ium-1-yl]-N,N-dipropyl-acetamide Formula: C18H29N4O5S+ MolecularWeight: 413.51166

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCCN(CCC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H28N4O5S/c1-3-9-20(10-4-2)18(23)15-19-11-13-21(14-12-19)28(26,27)17-8-6-5-7-16(17)22(24)25/h5-8H,3-4,9-15H2,1-2H3/p+1