2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-(propan-2-ylcarbamoyl)ethanamide

Systemtic Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: N-(isopropylcarbamoyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: 2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-N-[oxo-(propan-2-ylamino)methyl]acetamide IUPAC Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: N-(isopropylcarbamoyl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C16H22N4O7S MolecularWeight: 414.43348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O7S/c1-11(2)17-16(22)18-15(21)10-27-14-6-5-12(9-13(14)20(23)24)28(25,26)19-7-3-4-8-19/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H2,17,18,21,22)