(phenylmethyl) 4-(12-bromanyldodecoxy)benzoate

Systemtic Name: (phenylmethyl) 4-(12-bromanyldodecoxy)benzoate Openeye Name: benzyl 4-(12-bromododecoxy)benzoate CAS Name: 4-(12-bromododecoxy)benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(12-bromododecoxy)benzoate Traditional Name: 4-(12-bromododecoxy)benzoic acid benzyl ester Formula: C26H35BrO3 MolecularWeight: 475.4583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OCCCCCCCCCCCCBr

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OCCCCCCCCCCCCBr

InChI

InChI=1S/C26H35BrO3/c27-20-12-7-5-3-1-2-4-6-8-13-21-29-25-18-16-24(17-19-25)26(28)30-22-23-14-10-9-11-15-23/h9-11,14-19H,1-8,12-13,20-22H2