[4-(1-cyano-2-hexyl-cyclopropyl)phenyl] 4-octoxybenzoate

Systemtic Name: [4-(1-cyano-2-hexyl-cyclopropyl)phenyl] 4-octoxybenzoate Openeye Name: [4-(1-cyano-2-hexyl-cyclopropyl)phenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-(1-cyano-2-hexylcyclopropyl)phenyl] ester IUPAC Name: [4-(1-cyano-2-hexylcyclopropyl)phenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-(1-cyano-2-hexyl-cyclopropyl)phenyl] ester Formula: C31H41NO3 MolecularWeight: 475.66214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3(CC3CCCCCC)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3(CC3CCCCCC)C#N

InChI

InChI=1S/C31H41NO3/c1-3-5-7-9-10-12-22-34-28-18-14-25(15-19-28)30(33)35-29-20-16-26(17-21-29)31(24-32)23-27(31)13-11-8-6-4-2/h14-21,27H,3-13,22-23H2,1-2H3