2,3,5-trimethyl-6-(1-pyridin-3-ylethyl)cyclohexa-2,5-diene-1,4-dione hydrochloride

Systemtic Name: 2,3,5-trimethyl-6-(1-pyridin-3-ylethyl)cyclohexa-2,5-diene-1,4-dione hydrochloride Openeye Name: 2,3,5-trimethyl-6-[1-(3-pyridyl)ethyl]-1,4-benzoquinone hydrochloride CAS Name: 2,3,5-trimethyl-6-[1-(3-pyridinyl)ethyl]cyclohexa-2,5-diene-1,4-dione hydrochloride IUPAC Name: 2,3,5-trimethyl-6-(1-pyridin-3-ylethyl)cyclohexa-2,5-diene-1,4-dione hydrochloride Traditional Name: 2,3,5-trimethyl-6-[1-(3-pyridyl)ethyl]-p-benzoquinone hydrochloride Formula: C16H18ClNO2 MolecularWeight: 291.77262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(C1=O)C)C(C)C2=CN=CC=C2)C.Cl

Isomeric SMILES

CC1=C(C(=O)C(=C(C1=O)C)C(C)C2=CN=CC=C2)C.Cl

InChI

InChI=1S/C16H17NO2.ClH/c1-9-10(2)16(19)14(12(4)15(9)18)11(3)13-6-5-7-17-8-13;/h5-8,11H,1-4H3;1H