[(2S)-4-[(4-methoxyphenyl)methoxy]-2-oxidanyl-butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate

Systemtic Name: [(2S)-4-[(4-methoxyphenyl)methoxy]-2-oxidanyl-butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate Openeye Name: [(2S)-2-hydroxy-4-[(4-methoxyphenyl)methoxy]butyl] 2,4,6-triisopropylbenzenesulfonate CAS Name: 2,4,6-tri(propan-2-yl)benzenesulfonic acid [(2S)-2-hydroxy-4-[(4-methoxyphenyl)methoxy]butyl] ester IUPAC Name: [(2S)-2-hydroxy-4-[(4-methoxyphenyl)methoxy]butyl] 2,4,6-tri(propan-2-yl)benzenesulfonate Traditional Name: 2,4,6-triisopropylbenzenesulfonic acid [(2S)-2-hydroxy-4-p-anisyloxy-butyl] ester Formula: C27H40O6S MolecularWeight: 492.6679

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OCC(CCOCC2=CC=C(C=C2)OC)O)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)C(C)C)S(=O)(=O)OC[C@H](CCOCC2=CC=C(C=C2)OC)O)C(C)C

InChI

InChI=1S/C27H40O6S/c1-18(2)22-14-25(19(3)4)27(26(15-22)20(5)6)34(29,30)33-17-23(28)12-13-32-16-21-8-10-24(31-7)11-9-21/h8-11,14-15,18-20,23,28H,12-13,16-17H2,1-7H3/t23-/m0/s1