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

Systemtic Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-1-pyrrolidin-1-yl-propan-1-one CAS Name: 2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)-1-pyrrolidino-propan-1-one Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1CCCC1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O6S/c1-13(17(21)18-8-2-3-9-18)26-16-7-6-14(12-15(16)20(22)23)27(24,25)19-10-4-5-11-19/h6-7,12-13H,2-5,8-11H2,1H3