(2,5-dimethylphenyl)methyl 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: (2,5-dimethylphenyl)methyl 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: (2,5-dimethylphenyl)methyl 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid (2,5-dimethylphenyl)methyl ester IUPAC Name: (2,5-dimethylphenyl)methyl 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid (2,5-dimethylbenzyl) ester Formula: C21H19ClO2S MolecularWeight: 370.89236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)COC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)COC(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C21H19ClO2S/c1-14-9-10-15(2)17(11-14)12-24-20(23)13-25-19-8-4-6-16-5-3-7-18(22)21(16)19/h3-11H,12-13H2,1-2H3