3-(2,2-dimethylpropyl)-7-propyl-1,2-benzoxazole

Systemtic Name: 3-(2,2-dimethylpropyl)-7-propyl-1,2-benzoxazole Openeye Name: 3-(2,2-dimethylpropyl)-7-propyl-1,2-benzoxazole CAS Name: 3-(2,2-dimethylpropyl)-7-propyl-1,2-benzoxazole IUPAC Name: 3-(2,2-dimethylpropyl)-7-propyl-1,2-benzoxazole Traditional Name: 3-neopentyl-7-propyl-indoxazene Formula: C15H21NO MolecularWeight: 231.33334

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1ON=C2CC(C)(C)C

Isomeric SMILES

CCCC1=CC=CC2=C1ON=C2CC(C)(C)C

InChI

InChI=1S/C15H21NO/c1-5-7-11-8-6-9-12-13(10-15(2,3)4)16-17-14(11)12/h6,8-9H,5,7,10H2,1-4H3