(5-chloranylthiophen-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-chloranylthiophen-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (5-chloro-2-thienyl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (5-chloro-2-thiophenyl)-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-chlorothiophen-2-yl)-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (5-chloro-2-thienyl)-(4-p-anisylpiperazin-4-ium-1-yl)methanone Formula: C17H20ClN2O2S+ MolecularWeight: 351.8709

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H19ClN2O2S/c1-22-14-4-2-13(3-5-14)12-19-8-10-20(11-9-19)17(21)15-6-7-16(18)23-15/h2-7H,8-12H2,1H3/p+1