[4-[1,1,1-tris(fluoranyl)-3-oxidanylidene-3-pentoxy-propan-2-yl]oxycarbonylphenyl] 4-nonoxybenzoate

Systemtic Name: [4-[1,1,1-tris(fluoranyl)-3-oxidanylidene-3-pentoxy-propan-2-yl]oxycarbonylphenyl] 4-nonoxybenzoate Openeye Name: [4-(2,2,2-trifluoro-1-pentoxycarbonyl-ethoxy)carbonylphenyl] 4-nonoxybenzoate CAS Name: 4-nonoxybenzoic acid [4-[oxo-(1,1,1-trifluoro-3-oxo-3-pentoxypropan-2-yl)oxymethyl]phenyl] ester IUPAC Name: [4-(1,1,1-trifluoro-3-oxo-3-pentoxypropan-2-yl)oxycarbonylphenyl] 4-nonoxybenzoate Traditional Name: 4-nonoxybenzoic acid [4-(1-amoxycarbonyl-2,2,2-trifluoro-ethoxy)carbonylphenyl] ester Formula: C31H39F3O7 MolecularWeight: 580.63237

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C(=O)OCCCCC)C(F)(F)F

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC(C(=O)OCCCCC)C(F)(F)F

InChI

InChI=1S/C31H39F3O7/c1-3-5-7-8-9-10-12-21-38-25-17-13-23(14-18-25)28(35)40-26-19-15-24(16-20-26)29(36)41-27(31(32,33)34)30(37)39-22-11-6-4-2/h13-20,27H,3-12,21-22H2,1-2H3