1,2-diethyl-3,6,6-trimethyl-5,7-dihydroindazol-1-ium-4-one iodide

Systemtic Name: 1,2-diethyl-3,6,6-trimethyl-5,7-dihydroindazol-1-ium-4-one iodide Openeye Name: 1,2-diethyl-3,6,6-trimethyl-5,7-dihydroindazol-1-ium-4-one iodide CAS Name: 1,2-diethyl-3,6,6-trimethyl-5,7-dihydroindazol-1-ium-4-one iodide IUPAC Name: 1,2-diethyl-3,6,6-trimethyl-5,7-dihydroindazol-1-ium-4-one iodide Traditional Name: 1,2-diethyl-3,6,6-trimethyl-5,7-dihydroindazol-1-ium-4-one iodide Formula: C14H23IN2O MolecularWeight: 362.24969

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C2C(=[N+]1CC)CC(CC2=O)(C)C)C.[I-]

Isomeric SMILES

CCN1C(=C2C(=[N+]1CC)CC(CC2=O)(C)C)C.[I-]

InChI

InChI=1S/C14H23N2O.HI/c1-6-15-10(3)13-11(16(15)7-2)8-14(4,5)9-12(13)17;/h6-9H2,1-5H3;1H/q+1;/p-1