piperazin-4-ium-1-yl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone

Systemtic Name: piperazin-4-ium-1-yl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Openeye Name: piperazin-4-ium-1-yl(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone CAS Name: 1-piperazin-4-iumyl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone IUPAC Name: piperazin-4-ium-1-yl(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Traditional Name: piperazin-4-ium-1-yl(4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone Formula: C13H19N2OS+ MolecularWeight: 251.36776

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C13H18N2OS/c16-13(15-7-5-14-6-8-15)12-9-10-3-1-2-4-11(10)17-12/h9,14H,1-8H2/p+1