3-(1-oxidanylhexyl)-4-(4-oxidanylidenecyclohexa-1,5-dien-1-yl)benzenecarbonitrile

Systemtic Name: 3-(1-oxidanylhexyl)-4-(4-oxidanylidenecyclohexa-1,5-dien-1-yl)benzenecarbonitrile Openeye Name: 3-(1-hydroxyhexyl)-4-(4-oxocyclohexa-1,5-dien-1-yl)benzonitrile CAS Name: 3-(1-hydroxyhexyl)-4-(4-oxo-1-cyclohexa-1,5-dienyl)benzonitrile IUPAC Name: 3-(1-hydroxyhexyl)-4-(4-oxocyclohexa-1,5-dien-1-yl)benzonitrile Traditional Name: 3-(1-hydroxyhexyl)-4-(4-ketocyclohexa-1,5-dien-1-yl)benzonitrile Formula: C19H21NO2 MolecularWeight: 295.37554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=C(C=CC(=C1)C#N)C2=CCC(=O)C=C2)O

Isomeric SMILES

CCCCCC(C1=C(C=CC(=C1)C#N)C2=CCC(=O)C=C2)O

InChI

InChI=1S/C19H21NO2/c1-2-3-4-5-19(22)18-12-14(13-20)6-11-17(18)15-7-9-16(21)10-8-15/h6-9,11-12,19,22H,2-5,10H2,1H3