1-(4-octoxyphenyl)cyclohexa-2,4-diene-1-carbonitrile

Systemtic Name: 1-(4-octoxyphenyl)cyclohexa-2,4-diene-1-carbonitrile Openeye Name: 1-(4-octoxyphenyl)cyclohexa-2,4-diene-1-carbonitrile CAS Name: 1-(4-octoxyphenyl)-1-cyclohexa-2,4-dienecarbonitrile IUPAC Name: 1-(4-octoxyphenyl)cyclohexa-2,4-diene-1-carbonitrile Traditional Name: 1-(4-octoxyphenyl)cyclohexa-2,4-diene-1-carbonitrile Formula: C21H27NO MolecularWeight: 309.44518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2(CC=CC=C2)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2(CC=CC=C2)C#N

InChI

InChI=1S/C21H27NO/c1-2-3-4-5-6-10-17-23-20-13-11-19(12-14-20)21(18-22)15-8-7-9-16-21/h7-9,11-15H,2-6,10,16-17H2,1H3