(3-chloranyl-1-benzothiophen-2-yl)-piperazin-4-ium-1-yl-methanone

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)-piperazin-4-ium-1-yl-methanone Openeye Name: (3-chlorobenzothiophen-2-yl)-piperazin-4-ium-1-yl-methanone CAS Name: (3-chloro-1-benzothiophen-2-yl)-(1-piperazin-4-iumyl)methanone IUPAC Name: (3-chloro-1-benzothiophen-2-yl)-piperazin-4-ium-1-ylmethanone Traditional Name: (3-chlorobenzothiophen-2-yl)-piperazin-4-ium-1-yl-methanone Formula: C13H14ClN2OS+ MolecularWeight: 281.78106

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C13H13ClN2OS/c14-11-9-3-1-2-4-10(9)18-12(11)13(17)16-7-5-15-6-8-16/h1-4,15H,5-8H2/p+1