(4-ethylpiperazin-4-ium-1-yl)-[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-yl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[(4Z)-4-hydroxyimino-3,6,6-trimethyl-5,7-dihydro-1-benzofuran-2-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[(4Z)-4-hydroximino-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-yl]methanone Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(C3=C(O2)CC(CC3=NO)(C)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(C\3=C(O2)CC(C/C3=N/O)(C)C)C

InChI

InChI=1S/C18H27N3O3/c1-5-20-6-8-21(9-7-20)17(22)16-12(2)15-13(19-23)10-18(3,4)11-14(15)24-16/h23H,5-11H2,1-4H3/p+1/b19-13-