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

Systemtic Name: methyl 3-[2-[(3-chloranyl-4-methoxy-phenyl)-methylsulfonyl-amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-(3-chloro-4-methoxy-N-methylsulfonyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-chloro-4-methoxy-N-methylsulfonylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(3-chloro-N-mesyl-4-methoxy-anilino)acetyl]amino]benzoic acid methyl ester Formula: C18H19ClN2O6S MolecularWeight: 426.87126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC(=C2)C(=O)OC)S(=O)(=O)C)Cl

InChI

InChI=1S/C18H19ClN2O6S/c1-26-16-8-7-14(10-15(16)19)21(28(3,24)25)11-17(22)20-13-6-4-5-12(9-13)18(23)27-2/h4-10H,11H2,1-3H3,(H,20,22)