1-(5-chloranylthiophen-2-yl)-2-isoquinolin-2-ium-2-yl-ethanone

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-2-isoquinolin-2-ium-2-yl-ethanone Openeye Name: 1-(5-chloro-2-thienyl)-2-isoquinolin-2-ium-2-yl-ethanone CAS Name: 1-(5-chloro-2-thiophenyl)-2-(2-isoquinolin-2-iumyl)ethanone IUPAC Name: 1-(5-chlorothiophen-2-yl)-2-isoquinolin-2-ium-2-ylethanone Traditional Name: 1-(5-chloro-2-thienyl)-2-isoquinolin-2-ium-2-yl-ethanone Formula: C15H11ClNOS+ MolecularWeight: 288.77194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C15H11ClNOS/c16-15-6-5-14(19-15)13(18)10-17-8-7-11-3-1-2-4-12(11)9-17/h1-9H,10H2/q+1