[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: [2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: [2-(2,4-dimethoxyphenyl)-2-oxo-ethyl] 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid [2-(2,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyphenyl)-2-oxoethyl] 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid [2-(2,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C22H19ClO5S MolecularWeight: 430.90126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)COC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)COC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl)OC

InChI

InChI=1S/C22H19ClO5S/c1-26-15-9-10-16(19(11-15)27-2)18(24)12-28-21(25)13-29-20-8-4-6-14-5-3-7-17(23)22(14)20/h3-11H,12-13H2,1-2H3