methyl 4-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]benzoate Openeye Name: methyl 4-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate CAS Name: 4-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(3-pyrrolidinosulfonylbenzoyl)amino]benzoic acid methyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5S/c1-26-19(23)14-7-9-16(10-8-14)20-18(22)15-5-4-6-17(13-15)27(24,25)21-11-2-3-12-21/h4-10,13H,2-3,11-12H2,1H3,(H,20,22)