N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-oxidanylidene-chromene-6-sulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-oxidanylidene-chromene-6-sulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-oxo-chromene-6-sulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-oxo-1-benzopyran-6-sulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-oxochromene-6-sulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-keto-chromene-6-sulfonamide Formula: C19H17ClN2O6S2 MolecularWeight: 468.93108

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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)OC(=O)C=C4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=O)C=C4)Cl

InChI

InChI=1S/C19H17ClN2O6S2/c20-16-6-4-14(12-18(16)30(26,27)22-9-1-2-10-22)21-29(24,25)15-5-7-17-13(11-15)3-8-19(23)28-17/h3-8,11-12,21H,1-2,9-10H2