[3,6-bis(chloranyl)-1-benzothiophen-2-yl]-piperazin-4-ium-1-yl-methanone

Systemtic Name: [3,6-bis(chloranyl)-1-benzothiophen-2-yl]-piperazin-4-ium-1-yl-methanone Openeye Name: (3,6-dichlorobenzothiophen-2-yl)-piperazin-4-ium-1-yl-methanone CAS Name: (3,6-dichloro-1-benzothiophen-2-yl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (3,6-dichloro-1-benzothiophen-2-yl)-piperazin-4-ium-1-ylmethanone Traditional Name: (3,6-dichlorobenzothiophen-2-yl)-piperazin-4-ium-1-yl-methanone Formula: C13H13Cl2N2OS+ MolecularWeight: 316.22612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C13H12Cl2N2OS/c14-8-1-2-9-10(7-8)19-12(11(9)15)13(18)17-5-3-16-4-6-17/h1-2,7,16H,3-6H2/p+1