[(2S,3R)-3-bromanyl-1,4-bis(phenylmethoxy)butan-2-yl] benzoate

Systemtic Name: [(2S,3R)-3-bromanyl-1,4-bis(phenylmethoxy)butan-2-yl] benzoate Openeye Name: [(1S,2R)-3-benzyloxy-1-(benzyloxymethyl)-2-bromo-propyl] benzoate CAS Name: benzoic acid [(2S,3R)-3-bromo-1,4-bis(phenylmethoxy)butan-2-yl] ester IUPAC Name: [(2S,3R)-3-bromo-1,4-bis(phenylmethoxy)butan-2-yl] benzoate Traditional Name: benzoic acid [(1S,2R)-3-benzoxy-1-(benzoxymethyl)-2-bromo-propyl] ester Formula: C25H25BrO4 MolecularWeight: 469.3676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(C(COCC2=CC=CC=C2)Br)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)COC[C@@H]([C@@H](COCC2=CC=CC=C2)Br)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H25BrO4/c26-23(18-28-16-20-10-4-1-5-11-20)24(19-29-17-21-12-6-2-7-13-21)30-25(27)22-14-8-3-9-15-22/h1-15,23-24H,16-19H2/t23-,24+/m1/s1