N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-keto-3H-1,3-benzoxazole-6-sulfonamide Formula: C17H16ClN3O6S2 MolecularWeight: 457.90844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4)Cl

InChI

InChI=1S/C17H16ClN3O6S2/c18-13-5-3-11(9-16(13)29(25,26)21-7-1-2-8-21)20-28(23,24)12-4-6-14-15(10-12)27-17(22)19-14/h3-6,9-10,20H,1-2,7-8H2,(H,19,22)