[4-(4-nitrophenyl)piperazin-4-ium-1-yl]-thiophen-2-yl-methanone chloride

Systemtic Name: [4-(4-nitrophenyl)piperazin-4-ium-1-yl]-thiophen-2-yl-methanone chloride Openeye Name: [4-(4-nitrophenyl)piperazin-4-ium-1-yl]-(2-thienyl)methanone chloride CAS Name: [4-(4-nitrophenyl)-1-piperazin-4-iumyl]-thiophen-2-ylmethanone chloride IUPAC Name: [4-(4-nitrophenyl)piperazin-4-ium-1-yl]-thiophen-2-ylmethanone chloride Traditional Name: [4-(4-nitrophenyl)piperazin-4-ium-1-yl]-(2-thienyl)methanone chloride Formula: C15H16ClN3O3S MolecularWeight: 353.82384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CS3.[Cl-]

Isomeric SMILES

C1CN(CC[NH+]1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CS3.[Cl-]

InChI

InChI=1S/C15H15N3O3S.ClH/c19-15(14-2-1-11-22-14)17-9-7-16(8-10-17)12-3-5-13(6-4-12)18(20)21;/h1-6,11H,7-10H2;1H