2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-propan-2-yl-propanamide

Systemtic Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-propan-2-yl-propanamide Openeye Name: N-isopropyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide CAS Name: 2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-N-propan-2-ylpropanamide IUPAC Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)-N-propan-2-ylpropanamide Traditional Name: N-isopropyl-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propionamide Formula: C16H23N3O6S MolecularWeight: 385.43532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)C(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O6S/c1-11(2)17-16(20)12(3)25-15-7-6-13(10-14(15)19(21)22)26(23,24)18-8-4-5-9-18/h6-7,10-12H,4-5,8-9H2,1-3H3,(H,17,20)