N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N-(6-chloranyl-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N-(6-chloro-1,3-benzodioxol-5-yl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C19H18ClN3O8S MolecularWeight: 483.87952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3=CC4=C(C=C3Cl)OCO4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)NC3=CC4=C(C=C3Cl)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H18ClN3O8S/c20-13-8-17-18(31-11-30-17)9-14(13)21-19(24)10-29-16-4-3-12(7-15(16)23(25)26)32(27,28)22-5-1-2-6-22/h3-4,7-9H,1-2,5-6,10-11H2,(H,21,24)