2,6-ditert-butyl-4-(3-methyl-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride

Systemtic Name: 2,6-ditert-butyl-4-(3-methyl-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride Openeye Name: 2,6-ditert-butyl-4-(3-methyl-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride CAS Name: 2,6-ditert-butyl-4-(3-methyl-1H-imidazol-2-ylidene)-1-cyclohexa-2,5-dienone hydrochloride IUPAC Name: 2,6-ditert-butyl-4-(3-methyl-1H-imidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride Traditional Name: 2,6-ditert-butyl-4-(1-methyl-4-imidazolin-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride Formula: C18H27ClN2O MolecularWeight: 322.87278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NC=CN2C)C=C(C1=O)C(C)(C)C.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C2NC=CN2C)C=C(C1=O)C(C)(C)C.Cl

InChI

InChI=1S/C18H26N2O.ClH/c1-17(2,3)13-10-12(16-19-8-9-20(16)7)11-14(15(13)21)18(4,5)6;/h8-11,19H,1-7H3;1H