1-(4-tert-butylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one

Systemtic Name: 1-(4-tert-butylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Openeye Name: 1-(4-tert-butylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one CAS Name: 1-(4-tert-butylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)-2-butanone IUPAC Name: 1-(4-tert-butylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Traditional Name: 1-(4-tert-butylphenoxy)-3,3-dimethyl-1-(1,2,4-triazol-1-yl)butan-2-one Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC(C(=O)C(C)(C)C)N2C=NC=N2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC(C(=O)C(C)(C)C)N2C=NC=N2

InChI

InChI=1S/C18H25N3O2/c1-17(2,3)13-7-9-14(10-8-13)23-16(15(22)18(4,5)6)21-12-19-11-20-21/h7-12,16H,1-6H3