4-(3-azanyl-1,2,4-triazol-1-yl)-2,6-ditert-butyl-phenol hydrochloride

Systemtic Name: 4-(3-azanyl-1,2,4-triazol-1-yl)-2,6-ditert-butyl-phenol hydrochloride Openeye Name: 4-(3-amino-1,2,4-triazol-1-yl)-2,6-ditert-butyl-phenol hydrochloride CAS Name: 4-(3-amino-1,2,4-triazol-1-yl)-2,6-ditert-butylphenol hydrochloride IUPAC Name: 4-(3-amino-1,2,4-triazol-1-yl)-2,6-ditert-butylphenol hydrochloride Traditional Name: 4-(3-amino-1,2,4-triazol-1-yl)-2,6-ditert-butyl-phenol hydrochloride Formula: C16H25ClN4O MolecularWeight: 324.8489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2C=NC(=N2)N.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N2C=NC(=N2)N.Cl

InChI

InChI=1S/C16H24N4O.ClH/c1-15(2,3)11-7-10(20-9-18-14(17)19-20)8-12(13(11)21)16(4,5)6;/h7-9,21H,1-6H3,(H2,17,19);1H