6-methoxy-3-(1-pyridin-2-ylpiperazin-1-ium-1-yl)-1,2-benzoxazole

Systemtic Name: 6-methoxy-3-(1-pyridin-2-ylpiperazin-1-ium-1-yl)-1,2-benzoxazole Openeye Name: 6-methoxy-3-[1-(2-pyridyl)piperazin-1-ium-1-yl]-1,2-benzoxazole CAS Name: 6-methoxy-3-[1-(2-pyridinyl)-1-piperazin-1-iumyl]-1,2-benzoxazole IUPAC Name: 6-methoxy-3-(1-pyridin-2-ylpiperazin-1-ium-1-yl)-1,2-benzoxazole Traditional Name: 6-methoxy-3-[1-(2-pyridyl)piperazin-1-ium-1-yl]indoxazene Formula: C17H19N4O2+ MolecularWeight: 311.35836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=NO2)[N+]3(CCNCC3)C4=CC=CC=N4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=NO2)[N+]3(CCNCC3)C4=CC=CC=N4

InChI

InChI=1S/C17H19N4O2/c1-22-13-5-6-14-15(12-13)23-20-17(14)21(10-8-18-9-11-21)16-4-2-3-7-19-16/h2-7,12,18H,8-11H2,1H3/q+1