1-[4-(4-tert-butyl-2-chloranyl-phenoxy)butyl]-1,2,4-triazole

Systemtic Name: 1-[4-(4-tert-butyl-2-chloranyl-phenoxy)butyl]-1,2,4-triazole Openeye Name: 1-[4-(4-tert-butyl-2-chloro-phenoxy)butyl]-1,2,4-triazole CAS Name: 1-[4-(4-tert-butyl-2-chlorophenoxy)butyl]-1,2,4-triazole IUPAC Name: 1-[4-(4-tert-butyl-2-chlorophenoxy)butyl]-1,2,4-triazole Traditional Name: 1-[4-(4-tert-butyl-2-chloro-phenoxy)butyl]-1,2,4-triazole Formula: C16H22ClN3O MolecularWeight: 307.81838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCCCCN2C=NC=N2)Cl

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCCCCN2C=NC=N2)Cl

InChI

InChI=1S/C16H22ClN3O/c1-16(2,3)13-6-7-15(14(17)10-13)21-9-5-4-8-20-12-18-11-19-20/h6-7,10-12H,4-5,8-9H2,1-3H3