phenyl 4-[4-(2-fluoranyldecoxy)phenyl]-3-pentoxy-benzoate

Systemtic Name: phenyl 4-[4-(2-fluoranyldecoxy)phenyl]-3-pentoxy-benzoate Openeye Name: phenyl 4-[4-(2-fluorodecoxy)phenyl]-3-pentoxy-benzoate CAS Name: 4-[4-(2-fluorodecoxy)phenyl]-3-pentoxybenzoic acid phenyl ester IUPAC Name: phenyl 4-[4-(2-fluorodecoxy)phenyl]-3-pentoxybenzoate Traditional Name: 3-amoxy-4-[4-(2-fluorodecoxy)phenyl]benzoic acid phenyl ester Formula: C34H43FO4 MolecularWeight: 534.701223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(COC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3)OCCCCC)F

Isomeric SMILES

CCCCCCCCC(COC1=CC=C(C=C1)C2=C(C=C(C=C2)C(=O)OC3=CC=CC=C3)OCCCCC)F

InChI

InChI=1S/C34H43FO4/c1-3-5-7-8-9-11-15-29(35)26-38-30-21-18-27(19-22-30)32-23-20-28(25-33(32)37-24-14-6-4-2)34(36)39-31-16-12-10-13-17-31/h10,12-13,16-23,25,29H,3-9,11,14-15,24,26H2,1-2H3