1-(4-chloranyl-2-nitro-phenyl)-4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(4-chloranyl-2-nitro-phenyl)-4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(4-chloro-2-nitro-phenyl)-4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium CAS Name: 1-(4-chloro-2-nitrophenyl)-4-[(5-chloro-2-thiophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(4-chloro-2-nitrophenyl)-4-[(5-chlorothiophen-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(4-chloro-2-nitro-phenyl)-4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium Formula: C15H16Cl2N3O2S+ MolecularWeight: 373.27744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H15Cl2N3O2S/c16-11-1-3-13(14(9-11)20(21)22)19-7-5-18(6-8-19)10-12-2-4-15(17)23-12/h1-4,9H,5-8,10H2/p+1