methyl 2-[3,8-bis(chloranyl)-7-(2-methoxy-2-oxidanylidene-ethyl)thianthren-2-yl]ethanoate

Systemtic Name: methyl 2-[3,8-bis(chloranyl)-7-(2-methoxy-2-oxidanylidene-ethyl)thianthren-2-yl]ethanoate Openeye Name: methyl 2-[3,8-dichloro-7-(2-methoxy-2-oxo-ethyl)thianthren-2-yl]acetate CAS Name: 2-[3,8-dichloro-7-(2-methoxy-2-oxoethyl)-2-thianthrenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3,8-dichloro-7-(2-methoxy-2-oxoethyl)thianthren-2-yl]acetate Traditional Name: 2-[3,8-dichloro-7-(2-keto-2-methoxy-ethyl)thianthren-2-yl]acetic acid methyl ester Formula: C18H14Cl2O4S2 MolecularWeight: 429.33736

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC2=C(C=C1Cl)SC3=C(S2)C=C(C(=C3)CC(=O)OC)Cl

Isomeric SMILES

COC(=O)CC1=CC2=C(C=C1Cl)SC3=C(S2)C=C(C(=C3)CC(=O)OC)Cl

InChI

InChI=1S/C18H14Cl2O4S2/c1-23-17(21)5-9-3-13-15(7-11(9)19)26-14-4-10(6-18(22)24-2)12(20)8-16(14)25-13/h3-4,7-8H,5-6H2,1-2H3