1-benzothiophen-3-yl-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone

Systemtic Name: 1-benzothiophen-3-yl-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(benzothiophen-3-yl)methanone CAS Name: 1-benzothiophen-3-yl-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: 1-benzothiophen-3-yl-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(benzothiophen-3-yl)methanone Formula: C16H19N2OS+ MolecularWeight: 287.39986

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)C(=O)C2=CSC3=CC=CC=C32

Isomeric SMILES

C=CC[NH+]1CCN(CC1)C(=O)C2=CSC3=CC=CC=C32

InChI

InChI=1S/C16H18N2OS/c1-2-7-17-8-10-18(11-9-17)16(19)14-12-20-15-6-4-3-5-13(14)15/h2-6,12H,1,7-11H2/p+1