O4-methyl O1-(phenylmethyl) (E)-2-[(S)-(4-methylphenyl)sulfinyl]but-2-enedioate

Systemtic Name: O4-methyl O1-(phenylmethyl) (E)-2-[(S)-(4-methylphenyl)sulfinyl]but-2-enedioate Openeye Name: O1-benzyl O4-methyl (E)-2-[(S)-p-tolylsulfinyl]but-2-enedioate CAS Name: (E)-2-[(S)-(4-methylphenyl)sulfinyl]-2-butenedioic acid O4-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 4-O-methyl (E)-2-[(S)-(4-methylphenyl)sulfinyl]but-2-enedioate Traditional Name: (E)-2-[(S)-p-tolylsulfinyl]but-2-enedioic acid O1-benzyl ester O4-methyl ester Formula: C19H18O5S MolecularWeight: 358.40822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C(=CC(=O)OC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)/C(=C/C(=O)OC)/C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H18O5S/c1-14-8-10-16(11-9-14)25(22)17(12-18(20)23-2)19(21)24-13-15-6-4-3-5-7-15/h3-12H,13H2,1-2H3/b17-12+/t25-/m0/s1