4-[4-(3-fluoranyl-4-heptoxy-phenyl)phenyl]-1-nonyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(3-fluoranyl-4-heptoxy-phenyl)phenyl]-1-nonyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(3-fluoro-4-heptoxy-phenyl)phenyl]-1-nonyl-cyclohexanecarbonitrile CAS Name: 4-[4-(3-fluoro-4-heptoxyphenyl)phenyl]-1-nonyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(3-fluoro-4-heptoxyphenyl)phenyl]-1-nonylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(3-fluoro-4-heptoxy-phenyl)phenyl]-1-nonyl-cyclohexanecarbonitrile Formula: C35H50FNO MolecularWeight: 519.776003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCCCCCCC)F)C#N

Isomeric SMILES

CCCCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCCCCCCC)F)C#N

InChI

InChI=1S/C35H50FNO/c1-3-5-7-9-10-11-13-23-35(28-37)24-21-31(22-25-35)29-15-17-30(18-16-29)32-19-20-34(33(36)27-32)38-26-14-12-8-6-4-2/h15-20,27,31H,3-14,21-26H2,1-2H3