1-heptyl-4-(4-phenylphenyl)cyclohexa-2,5-diene-1-carbonitrile

Systemtic Name: 1-heptyl-4-(4-phenylphenyl)cyclohexa-2,5-diene-1-carbonitrile Openeye Name: 1-heptyl-4-(4-phenylphenyl)cyclohexa-2,5-diene-1-carbonitrile CAS Name: 1-heptyl-4-(4-phenylphenyl)-1-cyclohexa-2,5-dienecarbonitrile IUPAC Name: 1-heptyl-4-(4-phenylphenyl)cyclohexa-2,5-diene-1-carbonitrile Traditional Name: 1-heptyl-4-(4-phenylphenyl)cyclohexa-2,5-diene-1-carbonitrile Formula: C26H29N MolecularWeight: 355.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C=CC(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCCCC1(C=CC(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C26H29N/c1-2-3-4-5-9-18-26(21-27)19-16-25(17-20-26)24-14-12-23(13-15-24)22-10-7-6-8-11-22/h6-8,10-17,19-20,25H,2-5,9,18H2,1H3