3-[(E)-3,3-dimethylbut-1-enyl]-5,5-diphenyl-1,2,3-triazol-4-one

Systemtic Name: 3-[(E)-3,3-dimethylbut-1-enyl]-5,5-diphenyl-1,2,3-triazol-4-one Openeye Name: 3-[(E)-3,3-dimethylbut-1-enyl]-5,5-diphenyl-triazol-4-one CAS Name: 3-[(E)-3,3-dimethylbut-1-enyl]-5,5-diphenyl-4-triazolone IUPAC Name: 3-[(E)-3,3-dimethylbut-1-enyl]-5,5-diphenyltriazol-4-one Traditional Name: 3-[(E)-3,3-dimethylbut-1-enyl]-5,5-diphenyl-triazol-4-one Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=CN1C(=O)C(N=N1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)/C=C/N1C(=O)C(N=N1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O/c1-19(2,3)14-15-23-18(24)20(21-22-23,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-15H,1-3H3/b15-14+