methyl 2-[3-[oxidanyl-(2-phenyl-1,3-dithian-2-yl)methyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[oxidanyl-(2-phenyl-1,3-dithian-2-yl)methyl]phenoxy]ethanoate Openeye Name: methyl 2-[3-[hydroxy-(2-phenyl-1,3-dithian-2-yl)methyl]phenoxy]acetate CAS Name: 2-[3-[hydroxy-(2-phenyl-1,3-dithian-2-yl)methyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[hydroxy-(2-phenyl-1,3-dithian-2-yl)methyl]phenoxy]acetate Traditional Name: 2-[3-[hydroxy-(2-phenyl-1,3-dithian-2-yl)methyl]phenoxy]acetic acid methyl ester Formula: C20H22O4S2 MolecularWeight: 390.51628

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC(=C1)C(C2(SCCCS2)C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)COC1=CC=CC(=C1)C(C2(SCCCS2)C3=CC=CC=C3)O

InChI

InChI=1S/C20H22O4S2/c1-23-18(21)14-24-17-10-5-7-15(13-17)19(22)20(25-11-6-12-26-20)16-8-3-2-4-9-16/h2-5,7-10,13,19,22H,6,11-12,14H2,1H3