2,2-dimethyl-1,5-diphenyl-4-(1,2,4-triazol-1-yl)pentan-3-one

Systemtic Name: 2,2-dimethyl-1,5-diphenyl-4-(1,2,4-triazol-1-yl)pentan-3-one Openeye Name: 2,2-dimethyl-1,5-diphenyl-4-(1,2,4-triazol-1-yl)pentan-3-one CAS Name: 2,2-dimethyl-1,5-diphenyl-4-(1,2,4-triazol-1-yl)-3-pentanone IUPAC Name: 2,2-dimethyl-1,5-diphenyl-4-(1,2,4-triazol-1-yl)pentan-3-one Traditional Name: 2,2-dimethyl-1,5-diphenyl-4-(1,2,4-triazol-1-yl)pentan-3-one Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)C(=O)C(CC2=CC=CC=C2)N3C=NC=N3

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)C(=O)C(CC2=CC=CC=C2)N3C=NC=N3

InChI

InChI=1S/C21H23N3O/c1-21(2,14-18-11-7-4-8-12-18)20(25)19(24-16-22-15-23-24)13-17-9-5-3-6-10-17/h3-12,15-16,19H,13-14H2,1-2H3