ethyl 2-[[4-[3-(cyclopropylmethylsulfonyl)-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[[4-[3-(cyclopropylmethylsulfonyl)-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[4-[3-(cyclopropylmethylsulfonyl)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-oxo-acetate CAS Name: 2-[4-[3-(cyclopropylmethylsulfonyl)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[4-[3-(cyclopropylmethylsulfonyl)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetate Traditional Name: 2-[4-[3-(cyclopropylmethylsulfonyl)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-keto-acetic acid ethyl ester Formula: C22H25NO7S MolecularWeight: 447.5014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)NC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)O)S(=O)(=O)CC3CC3)C

Isomeric SMILES

CCOC(=O)C(=O)NC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)O)S(=O)(=O)CC3CC3)C

InChI

InChI=1S/C22H25NO7S/c1-4-29-22(26)21(25)23-16-9-13(2)20(14(3)10-16)30-17-7-8-18(24)19(11-17)31(27,28)12-15-5-6-15/h7-11,15,24H,4-6,12H2,1-3H3,(H,23,25)