4-[2-(4-methoxyphenoxy)ethyl]-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[2-(4-methoxyphenoxy)ethyl]-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[2-(4-methoxyphenoxy)ethyl]-N-[[2-(2-thienyl)oxazol-4-yl]methyl]piperazin-4-ium-1-carboxamide CAS Name: 4-[2-(4-methoxyphenoxy)ethyl]-N-[(2-thiophen-2-yl-4-oxazolyl)methyl]-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[2-(4-methoxyphenoxy)ethyl]-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-[2-(4-methoxyphenoxy)ethyl]-N-[[2-(2-thienyl)oxazol-4-yl]methyl]piperazin-4-ium-1-carboxamide Formula: C22H27N4O4S+ MolecularWeight: 443.53918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)NCC3=COC(=N3)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)NCC3=COC(=N3)C4=CC=CS4

InChI

InChI=1S/C22H26N4O4S/c1-28-18-4-6-19(7-5-18)29-13-12-25-8-10-26(11-9-25)22(27)23-15-17-16-30-21(24-17)20-3-2-14-31-20/h2-7,14,16H,8-13,15H2,1H3,(H,23,27)/p+1