(3-cyano-2-fluoranyl-phenyl) 4-[4-(3-prop-2-enoyloxypropyl)cyclohexyl]benzoate

Systemtic Name: (3-cyano-2-fluoranyl-phenyl) 4-[4-(3-prop-2-enoyloxypropyl)cyclohexyl]benzoate Openeye Name: (3-cyano-2-fluoro-phenyl) 4-[4-(3-prop-2-enoyloxypropyl)cyclohexyl]benzoate CAS Name: 4-[4-[3-(1-oxoprop-2-enoxy)propyl]cyclohexyl]benzoic acid (3-cyano-2-fluorophenyl) ester IUPAC Name: (3-cyano-2-fluorophenyl) 4-[4-(3-prop-2-enoyloxypropyl)cyclohexyl]benzoate Traditional Name: 4-[4-(3-acryloyloxypropyl)cyclohexyl]benzoic acid (3-cyano-2-fluoro-phenyl) ester Formula: C26H26FNO4 MolecularWeight: 435.487343

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=CC(=C3F)C#N

Isomeric SMILES

C=CC(=O)OCCCC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=CC(=C3F)C#N

InChI

InChI=1S/C26H26FNO4/c1-2-24(29)31-16-4-5-18-8-10-19(11-9-18)20-12-14-21(15-13-20)26(30)32-23-7-3-6-22(17-28)25(23)27/h2-3,6-7,12-15,18-19H,1,4-5,8-11,16H2