[(3-methoxy-5-oxidanyl-phenyl)-(2-phenyl-1,3-dithian-2-yl)methyl] ethanoate

Systemtic Name: [(3-methoxy-5-oxidanyl-phenyl)-(2-phenyl-1,3-dithian-2-yl)methyl] ethanoate Openeye Name: [(3-hydroxy-5-methoxy-phenyl)-(2-phenyl-1,3-dithian-2-yl)methyl] acetate CAS Name: acetic acid [(3-hydroxy-5-methoxyphenyl)-(2-phenyl-1,3-dithian-2-yl)methyl] ester IUPAC Name: [(3-hydroxy-5-methoxyphenyl)-(2-phenyl-1,3-dithian-2-yl)methyl] acetate Traditional Name: acetic acid [(3-hydroxy-5-methoxy-phenyl)-(2-phenyl-1,3-dithian-2-yl)methyl] ester Formula: C20H22O4S2 MolecularWeight: 390.51628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1=CC(=CC(=C1)OC)O)C2(SCCCS2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)OC(C1=CC(=CC(=C1)OC)O)C2(SCCCS2)C3=CC=CC=C3

InChI

InChI=1S/C20H22O4S2/c1-14(21)24-19(15-11-17(22)13-18(12-15)23-2)20(25-9-6-10-26-20)16-7-4-3-5-8-16/h3-5,7-8,11-13,19,22H,6,9-10H2,1-2H3