methyl 2,4-bis(fluoranyl)-5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate

Systemtic Name: methyl 2,4-bis(fluoranyl)-5-[(4-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate Openeye Name: methyl 2,4-difluoro-5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate CAS Name: 2,4-difluoro-5-[[oxo-[4-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2,4-difluoro-5-[(4-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 2,4-difluoro-5-[(4-pyrrolidinosulfonylbenzoyl)amino]benzoic acid methyl ester Formula: C19H18F2N2O5S MolecularWeight: 424.418426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1F)F)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H18F2N2O5S/c1-28-19(25)14-10-17(16(21)11-15(14)20)22-18(24)12-4-6-13(7-5-12)29(26,27)23-8-2-3-9-23/h4-7,10-11H,2-3,8-9H2,1H3,(H,22,24)