[4-[cyano(cyclohexyl)methoxy]carbonylphenyl] 4-(4-octylphenyl)benzoate

Systemtic Name: [4-[cyano(cyclohexyl)methoxy]carbonylphenyl] 4-(4-octylphenyl)benzoate Openeye Name: [4-[cyano(cyclohexyl)methoxy]carbonylphenyl] 4-(4-octylphenyl)benzoate CAS Name: 4-(4-octylphenyl)benzoic acid [4-[[cyano(cyclohexyl)methoxy]-oxomethyl]phenyl] ester IUPAC Name: [4-[cyano(cyclohexyl)methoxy]carbonylphenyl] 4-(4-octylphenyl)benzoate Traditional Name: 4-(4-octylphenyl)benzoic acid [4-[cyano(cyclohexyl)methoxy]carbonylphenyl] ester Formula: C36H41NO4 MolecularWeight: 551.71504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(C#N)C4CCCCC4

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(C#N)C4CCCCC4

InChI

InChI=1S/C36H41NO4/c1-2-3-4-5-6-8-11-27-14-16-28(17-15-27)29-18-20-31(21-19-29)35(38)40-33-24-22-32(23-25-33)36(39)41-34(26-37)30-12-9-7-10-13-30/h14-25,30,34H,2-13H2,1H3