2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-1,3-benzoxazole

Systemtic Name: 2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-1,3-benzoxazole Openeye Name: 2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-1,3-benzoxazole CAS Name: 2-[4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumyl]-1,3-benzoxazole IUPAC Name: 2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-1,3-benzoxazole Traditional Name: 2-[4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-yl]-1,3-benzoxazole Formula: C20H24N3O3+ MolecularWeight: 354.42286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H23N3O3/c1-24-16-6-8-17(9-7-16)25-15-14-22-10-12-23(13-11-22)20-21-18-4-2-3-5-19(18)26-20/h2-9H,10-15H2,1H3/p+1