(5-chloranylthiophen-2-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (5-chloranylthiophen-2-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (5-chloro-2-thienyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (5-chloro-2-thiophenyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (5-chlorothiophen-2-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (5-chloro-2-thienyl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C17H20ClN2OS+ MolecularWeight: 335.8715

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CC=C2)C(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H19ClN2OS/c18-16-7-6-15(22-16)17(21)20-12-10-19(11-13-20)9-8-14-4-2-1-3-5-14/h1-7H,8-13H2/p+1