5-(4-tert-butylphenyl)-1,2-dimethyl-1,2,4-triazol-3-one

Systemtic Name: 5-(4-tert-butylphenyl)-1,2-dimethyl-1,2,4-triazol-3-one Openeye Name: 5-(4-tert-butylphenyl)-1,2-dimethyl-1,2,4-triazol-3-one CAS Name: 5-(4-tert-butylphenyl)-1,2-dimethyl-1,2,4-triazol-3-one IUPAC Name: 5-(4-tert-butylphenyl)-1,2-dimethyl-1,2,4-triazol-3-one Traditional Name: 5-(4-tert-butylphenyl)-1,2-dimethyl-1,2,4-triazol-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC(=O)N(N2C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC(=O)N(N2C)C

InChI

InChI=1S/C14H19N3O/c1-14(2,3)11-8-6-10(7-9-11)12-15-13(18)17(5)16(12)4/h6-9H,1-5H3