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

Systemtic Name: 1-decoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile Openeye Name: 1-decoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile CAS Name: 1-decoxy-4-phenyl-1-cyclohexa-2,5-dienecarbonitrile IUPAC Name: 1-decoxy-4-phenylcyclohexa-2,5-diene-1-carbonitrile Traditional Name: 1-decoxy-4-phenyl-cyclohexa-2,5-diene-1-carbonitrile Formula: C23H31NO MolecularWeight: 337.49834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C#N

Isomeric SMILES

CCCCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C23H31NO/c1-2-3-4-5-6-7-8-12-19-25-23(20-24)17-15-22(16-18-23)21-13-10-9-11-14-21/h9-11,13-18,22H,2-8,12,19H2,1H3