3,3-diethyl-4-phenyl-bicyclo[2.2.0]hexa-1,5-diene; methane; cyanate

Systemtic Name: 3,3-diethyl-4-phenyl-bicyclo[2.2.0]hexa-1,5-diene; methane; cyanate Openeye Name: 3,3-diethyl-4-phenyl-bicyclo[2.2.0]hexa-1,5-diene; methane; cyanate CAS Name: 3,3-diethyl-4-phenylbicyclo[2.2.0]hexa-1,5-diene; methane; cyanate IUPAC Name: 3,3-diethyl-4-phenylbicyclo[2.2.0]hexa-1,5-diene; methane; cyanate Traditional Name: 3,3-diethyl-4-phenyl-bicyclo[2.2.0]hexa-1,5-diene; methane; cyanate Formula: C18H22NO- MolecularWeight: 268.37338

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Descriptors Computed from Structure

Canonical SMILES:

C.CCC1(C=C2C1(C=C2)C3=CC=CC=C3)CC.C(#N)[O-]

Isomeric SMILES

C.CCC1(C=C2C1(C=C2)C3=CC=CC=C3)CC.C(#N)[O-]

InChI

InChI=1S/C16H18.CHNO.CH4/c1-3-15(4-2)12-14-10-11-16(14,15)13-8-6-5-7-9-13;2-1-3;/h5-12H,3-4H2,1-2H3;3H;1H4/p-1