1-(phenylmethyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(phenylmethyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium Openeye Name: 1-benzyl-4-(3-thienylmethyl)piperazin-4-ium CAS Name: 1-(phenylmethyl)-4-(3-thiophenylmethyl)piperazin-4-ium IUPAC Name: 1-benzyl-4-(thiophen-3-ylmethyl)piperazin-4-ium Traditional Name: 1-benzyl-4-(3-thenyl)piperazin-4-ium Formula: C16H21N2S+ MolecularWeight: 273.41634

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C16H20N2S/c1-2-4-15(5-3-1)12-17-7-9-18(10-8-17)13-16-6-11-19-14-16/h1-6,11,14H,7-10,12-13H2/p+1