1-heptoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile

Systemtic Name: 1-heptoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile Openeye Name: 1-heptoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile CAS Name: 1-heptoxy-4-phenyl-1-cyclohexa-2,5-dienecarbonitrile IUPAC Name: 1-heptoxy-4-phenylcyclohexa-2,5-diene-1-carbonitrile Traditional Name: 1-heptoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile Formula: C20H25NO MolecularWeight: 295.4186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C20H25NO/c1-2-3-4-5-9-16-22-20(17-21)14-12-19(13-15-20)18-10-7-6-8-11-18/h6-8,10-15,19H,2-5,9,16H2,1H3