3-(4-ethylpiperazin-4-ium-1-yl)-5-methyl-pyridazino[3,4-b][1,4]benzoxazine

Systemtic Name: 3-(4-ethylpiperazin-4-ium-1-yl)-5-methyl-pyridazino[3,4-b][1,4]benzoxazine Openeye Name: 3-(4-ethylpiperazin-4-ium-1-yl)-5-methyl-pyridazino[3,4-b][1,4]benzoxazine CAS Name: 3-(4-ethyl-1-piperazin-4-iumyl)-5-methylpyridazino[3,4-b][1,4]benzoxazine IUPAC Name: 3-(4-ethylpiperazin-4-ium-1-yl)-5-methylpyridazino[3,4-b][1,4]benzoxazine Traditional Name: 3-(4-ethylpiperazin-4-ium-1-yl)-5-methyl-pyridazino[3,4-b][1,4]benzoxazine Formula: C17H22N5O+ MolecularWeight: 312.38948

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=NN=C3C(=C2)N(C4=CC=CC=C4O3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=NN=C3C(=C2)N(C4=CC=CC=C4O3)C

InChI

InChI=1S/C17H21N5O/c1-3-21-8-10-22(11-9-21)16-12-14-17(19-18-16)23-15-7-5-4-6-13(15)20(14)2/h4-7,12H,3,8-11H2,1-2H3/p+1