[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C22H20ClNO3S MolecularWeight: 413.9171

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20ClNO3S/c1-14-6-3-10-18(15(14)2)24-20(25)12-27-21(26)13-28-19-11-5-8-16-7-4-9-17(23)22(16)19/h3-11H,12-13H2,1-2H3,(H,24,25)