N,N-bis(2-methylpropyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide

Systemtic Name: N,N-bis(2-methylpropyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)ethanamide Openeye Name: N,N-diisobutyl-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)acetamide CAS Name: N,N-bis(2-methylpropyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]acetamide IUPAC Name: N,N-bis(2-methylpropyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)acetamide Traditional Name: N,N-diisobutyl-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)acetamide Formula: C20H31N3O6S MolecularWeight: 441.54164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31N3O6S/c1-15(2)12-21(13-16(3)4)20(24)14-29-19-8-7-17(11-18(19)23(25)26)30(27,28)22-9-5-6-10-22/h7-8,11,15-16H,5-6,9-10,12-14H2,1-4H3