3-tert-butyl-4-chloranyl-2-(phenylmethyl)-5H-1,2-oxazole

Systemtic Name: 3-tert-butyl-4-chloranyl-2-(phenylmethyl)-5H-1,2-oxazole Openeye Name: 2-benzyl-3-tert-butyl-4-chloro-5H-isoxazole CAS Name: 3-tert-butyl-4-chloro-2-(phenylmethyl)-5H-isoxazole IUPAC Name: 2-benzyl-3-tert-butyl-4-chloro-5H-1,2-oxazole Traditional Name: 2-benzyl-3-tert-butyl-4-chloro-3-isoxazoline Formula: C14H18ClNO MolecularWeight: 251.75182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(CON1CC2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)(C)C1=C(CON1CC2=CC=CC=C2)Cl

InChI

InChI=1S/C14H18ClNO/c1-14(2,3)13-12(15)10-17-16(13)9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3