3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; thiourea

Systemtic Name: 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; thiourea Openeye Name: 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; thiourea CAS Name: 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; thiourea IUPAC Name: 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; thiourea Traditional Name: 3-methoxybicyclo[2.2.1]hepta-1,3,5-triene; thiourea Formula: C9H12N2OS MolecularWeight: 196.26938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C2CC(=C1)C=C2.C(=S)(N)N

Isomeric SMILES

COC1=C2CC(=C1)C=C2.C(=S)(N)N

InChI

InChI=1S/C8H8O.CH4N2S/c1-9-8-5-6-2-3-7(8)4-6;2-1(3)4/h2-3,5H,4H2,1H3;(H4,2,3,4)