methyl 4-[2-[(5-chloranyl-2-ethoxy-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(5-chloranyl-2-ethoxy-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(5-chloro-2-ethoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-chloro-2-ethoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(5-chloro-2-ethoxyphenyl)sulfonyl-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-chloro-2-ethoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoic acid methyl ester Formula: C19H21ClN2O6S MolecularWeight: 440.89784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H21ClN2O6S/c1-4-28-16-10-7-14(20)11-17(16)29(25,26)22(2)12-18(23)21-15-8-5-13(6-9-15)19(24)27-3/h5-11H,4,12H2,1-3H3,(H,21,23)