[2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]carbonylphenyl]-thiophen-2-yl-methanone

Systemtic Name: [2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]carbonylphenyl]-thiophen-2-yl-methanone Openeye Name: [2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carbonyl]phenyl]-(2-thienyl)methanone CAS Name: [2-[[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-oxomethyl]phenyl]-thiophen-2-ylmethanone IUPAC Name: [2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carbonyl]phenyl]-thiophen-2-ylmethanone Traditional Name: [2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carbonyl]phenyl]-(2-thienyl)methanone Formula: C25H27N2O4S+ MolecularWeight: 451.55788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)C4=CC=CS4

InChI

InChI=1S/C25H26N2O4S/c1-30-19-8-10-20(11-9-19)31-17-16-26-12-14-27(15-13-26)25(29)22-6-3-2-5-21(22)24(28)23-7-4-18-32-23/h2-11,18H,12-17H2,1H3/p+1