[(2R)-2-(4-bromophenyl)carbonyloxy-3-(9-methylhexadecoxy)propyl] 4-bromanylbenzoate

Systemtic Name: [(2R)-2-(4-bromophenyl)carbonyloxy-3-(9-methylhexadecoxy)propyl] 4-bromanylbenzoate Openeye Name: [(2R)-2-(4-bromobenzoyl)oxy-3-(9-methylhexadecoxy)propyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(2R)-2-[(4-bromophenyl)-oxomethoxy]-3-(9-methylhexadecoxy)propyl] ester IUPAC Name: [(2R)-2-(4-bromobenzoyl)oxy-3-(9-methylhexadecoxy)propyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(2R)-2-(4-bromobenzoyl)oxy-3-(9-methylhexadecoxy)propyl] ester Formula: C34H48Br2O5 MolecularWeight: 696.54992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)CCCCCCCCOCC(COC(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCCCC(C)CCCCCCCCOC[C@H](COC(=O)C1=CC=C(C=C1)Br)OC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C34H48Br2O5/c1-3-4-5-8-11-14-27(2)15-12-9-6-7-10-13-24-39-25-32(41-34(38)29-18-22-31(36)23-19-29)26-40-33(37)28-16-20-30(35)21-17-28/h16-23,27,32H,3-15,24-26H2,1-2H3/t27?,32-/m1/s1