methyl 3-[2-[[2-chloranyl-5-(trifluoromethyl)phenyl]-methylsulfonyl-amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[[2-chloranyl-5-(trifluoromethyl)phenyl]-methylsulfonyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-chloro-N-methylsulfonyl-5-(trifluoromethyl)anilino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[2-chloro-N-mesyl-5-(trifluoromethyl)anilino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C19H18ClF3N2O5S MolecularWeight: 478.86983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C

InChI

InChI=1S/C19H18ClF3N2O5S/c1-11-4-5-12(18(27)30-2)8-15(11)24-17(26)10-25(31(3,28)29)16-9-13(19(21,22)23)6-7-14(16)20/h4-9H,10H2,1-3H3,(H,24,26)