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

Systemtic Name: [4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-(5-methylthiophen-2-yl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-(5-methyl-2-thienyl)methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-(5-methyl-2-thiophenyl)methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-(5-methylthiophen-2-yl)methanone Traditional Name: (5-methyl-2-thienyl)-(4-p-anisylpiperazin-4-ium-1-yl)methanone Formula: C18H23N2O2S+ MolecularWeight: 331.45242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(S1)C(=O)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H22N2O2S/c1-14-3-8-17(23-14)18(21)20-11-9-19(10-12-20)13-15-4-6-16(22-2)7-5-15/h3-8H,9-13H2,1-2H3/p+1