2-[[2,4-bis(chloranyl)-5-pyrrolidin-1-ylsulfonyl-phenyl]carbonylamino]benzoate

Systemtic Name: 2-[[2,4-bis(chloranyl)-5-pyrrolidin-1-ylsulfonyl-phenyl]carbonylamino]benzoate Openeye Name: 2-[(2,4-dichloro-5-pyrrolidin-1-ylsulfonyl-benzoyl)amino]benzoate CAS Name: 2-[[[2,4-dichloro-5-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]amino]benzoate IUPAC Name: 2-[(2,4-dichloro-5-pyrrolidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 2-[(2,4-dichloro-5-pyrrolidinosulfonyl-benzoyl)amino]benzoate Formula: C18H15Cl2N2O5S- MolecularWeight: 442.2931

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC3=CC=CC=C3C(=O)[O-])Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC3=CC=CC=C3C(=O)[O-])Cl)Cl

InChI

InChI=1S/C18H16Cl2N2O5S/c19-13-10-14(20)16(28(26,27)22-7-3-4-8-22)9-12(13)17(23)21-15-6-2-1-5-11(15)18(24)25/h1-2,5-6,9-10H,3-4,7-8H2,(H,21,23)(H,24,25)/p-1