3-tert-butyl-2-(1-chloranyl-2-phenyl-ethyl)-1H-1,2,3-triazole; ethanol

Systemtic Name: 3-tert-butyl-2-(1-chloranyl-2-phenyl-ethyl)-1H-1,2,3-triazole; ethanol Openeye Name: 3-tert-butyl-2-(1-chloro-2-phenyl-ethyl)-1H-triazole; ethanol CAS Name: 3-tert-butyl-2-(1-chloro-2-phenylethyl)-1H-triazole; ethanol IUPAC Name: 3-tert-butyl-2-(1-chloro-2-phenylethyl)-1H-triazole; ethanol Traditional Name: 3-tert-butyl-2-(1-chloro-2-phenyl-ethyl)-1H-triazole; ethanol Formula: C16H26ClN3O MolecularWeight: 311.85014

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CC(C)(C)N1C=CNN1C(CC2=CC=CC=C2)Cl

Isomeric SMILES

CCO.CC(C)(C)N1C=CNN1C(CC2=CC=CC=C2)Cl

InChI

InChI=1S/C14H20ClN3.C2H6O/c1-14(2,3)17-10-9-16-18(17)13(15)11-12-7-5-4-6-8-12;1-2-3/h4-10,13,16H,11H2,1-3H3;3H,2H2,1H3