ethyl 4-[2-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(5-fluoranyl-2-methoxy-phenyl)sulfonyl-methyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-fluoro-2-methoxy-phenyl)sulfonyl-methyl-amino]acetyl]amino]benzoic acid ethyl ester Formula: C19H21FN2O6S MolecularWeight: 424.443243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21FN2O6S/c1-4-28-19(24)13-5-8-15(9-6-13)21-18(23)12-22(2)29(25,26)17-11-14(20)7-10-16(17)27-3/h5-11H,4,12H2,1-3H3,(H,21,23)