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

Systemtic Name: methyl 4-[(3-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]benzoate Openeye Name: methyl 4-[(3-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]benzoate CAS Name: 4-[oxo-[3-(1-pyrrolidinylsulfonyl)anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-pyrrolidin-1-ylsulfonylphenyl)carbamoyl]benzoate Traditional Name: 4-[(3-pyrrolidinosulfonylphenyl)carbamoyl]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)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3

InChI

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