2,6-ditert-butyl-4-(4,5-diphenyl-1,3-dihydroimidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride

Systemtic Name: 2,6-ditert-butyl-4-(4,5-diphenyl-1,3-dihydroimidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride Openeye Name: 2,6-ditert-butyl-4-(4,5-diphenyl-1,3-dihydroimidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride CAS Name: 2,6-ditert-butyl-4-(4,5-diphenyl-1,3-dihydroimidazol-2-ylidene)-1-cyclohexa-2,5-dienone hydrochloride IUPAC Name: 2,6-ditert-butyl-4-(4,5-diphenyl-1,3-dihydroimidazol-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride Traditional Name: 2,6-ditert-butyl-4-(4,5-diphenyl-4-imidazolin-2-ylidene)cyclohexa-2,5-dien-1-one hydrochloride Formula: C29H33ClN2O MolecularWeight: 461.03812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)C=C(C1=O)C(C)(C)C.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C2NC(=C(N2)C3=CC=CC=C3)C4=CC=CC=C4)C=C(C1=O)C(C)(C)C.Cl

InChI

InChI=1S/C29H32N2O.ClH/c1-28(2,3)22-17-21(18-23(26(22)32)29(4,5)6)27-30-24(19-13-9-7-10-14-19)25(31-27)20-15-11-8-12-16-20;/h7-18,30-31H,1-6H3;1H