5-chloranyl-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pent-1-yn-3-ol

Systemtic Name: 5-chloranyl-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pent-1-yn-3-ol Openeye Name: 5-chloro-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pent-1-yn-3-ol CAS Name: 5-chloro-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)-1-pentyn-3-ol IUPAC Name: 5-chloro-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pent-1-yn-3-ol Traditional Name: 5-chloro-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pent-1-yn-3-ol Formula: C16H17Cl2N3O MolecularWeight: 338.23168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCl)C(CN1C=NC=N1)(C#CC2=CC=C(C=C2)Cl)O

Isomeric SMILES

CC(C)(CCl)C(CN1C=NC=N1)(C#CC2=CC=C(C=C2)Cl)O

InChI

InChI=1S/C16H17Cl2N3O/c1-15(2,9-17)16(22,10-21-12-19-11-20-21)8-7-13-3-5-14(18)6-4-13/h3-6,11-12,22H,9-10H2,1-2H3