ethylbenzene; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene

Systemtic Name: ethylbenzene; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene Openeye Name: ethylbenzene; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene CAS Name: ethylbenzene; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene IUPAC Name: ethylbenzene; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene Traditional Name: ethylbenzene; 6-oxabicyclo[3.1.1]hepta-1(7),2,4-triene Formula: C14H14O MolecularWeight: 198.26036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1.C1=CC2=CC(=C1)O2

Isomeric SMILES

CCC1=CC=CC=C1.C1=CC2=CC(=C1)O2

InChI

InChI=1S/C8H10.C6H4O/c1-2-8-6-4-3-5-7-8;1-2-5-4-6(3-1)7-5/h3-7H,2H2,1H3;1-4H