[(3S)-3-ethenoxy-4-phenylmethoxy-butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: [(3S)-3-ethenoxy-4-phenylmethoxy-butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: [(3S)-4-benzyloxy-3-vinyloxy-butyl] 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid [(3S)-3-ethenoxy-4-phenylmethoxybutyl] ester IUPAC Name: [(3S)-3-ethenoxy-4-phenylmethoxybutyl] 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid [(3S)-4-benzoxy-3-vinyloxy-butyl] ester Formula: C28H40O5S MolecularWeight: 488.6792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OCCC(COCC2=CC=CC=C2)OC=C)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OCC[C@@H](COCC2=CC=CC=C2)OC=C)C(C)C

InChI

InChI=1S/C28H40O5S/c1-8-32-25(19-31-18-23-12-10-9-11-13-23)14-15-33-34(29,30)28-26(21(4)5)16-24(20(2)3)17-27(28)22(6)7/h8-13,16-17,20-22,25H,1,14-15,18-19H2,2-7H3/t25-/m0/s1