3-heptyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene

Systemtic Name: 3-heptyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene Openeye Name: 3-heptyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene CAS Name: 3-heptyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene IUPAC Name: 3-heptyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene Traditional Name: 3-heptyl-7-thiabicyclo[2.2.1]hepta-1,3,5-triene Formula: C13H18S MolecularWeight: 206.34702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C2C=CC(=C1)S2

Isomeric SMILES

CCCCCCCC1=C2C=CC(=C1)S2

InChI

InChI=1S/C13H18S/c1-2-3-4-5-6-7-11-10-12-8-9-13(11)14-12/h8-10H,2-7H2,1H3