4-methoxy-7-(1-oxidanylcyclohexyl)bicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile

Systemtic Name: 4-methoxy-7-(1-oxidanylcyclohexyl)bicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile Openeye Name: 7-(1-hydroxycyclohexyl)-4-methoxy-bicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile CAS Name: 7-(1-hydroxycyclohexyl)-4-methoxy-7-bicyclo[4.2.0]octa-1(6),2,4-trienecarbonitrile IUPAC Name: 7-(1-hydroxycyclohexyl)-4-methoxybicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile Traditional Name: 7-(1-hydroxycyclohexyl)-4-methoxy-bicyclo[4.2.0]octa-1(6),2,4-triene-7-carbonitrile Formula: C16H19NO2 MolecularWeight: 257.32756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CC2(C#N)C3(CCCCC3)O)C=C1

Isomeric SMILES

COC1=CC2=C(CC2(C#N)C3(CCCCC3)O)C=C1

InChI

InChI=1S/C16H19NO2/c1-19-13-6-5-12-10-15(11-17,14(12)9-13)16(18)7-3-2-4-8-16/h5-6,9,18H,2-4,7-8,10H2,1H3