8-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-1,4-dioxa-8-azaspiro[4.5]decane

Systemtic Name: 8-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-1,4-dioxa-8-azaspiro[4.5]decane Openeye Name: 8-(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)-1,4-dioxa-8-azaspiro[4.5]decane CAS Name: 8-[4-nitro-2-(1-pyrrolidinylsulfonyl)phenyl]-1,4-dioxa-8-azaspiro[4.5]decane IUPAC Name: 8-(4-nitro-2-pyrrolidin-1-ylsulfonylphenyl)-1,4-dioxa-8-azaspiro[4.5]decane Traditional Name: 8-(4-nitro-2-pyrrolidinosulfonyl-phenyl)-1,4-dioxa-8-azaspiro[4.5]decane Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC4(CC3)OCCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCC4(CC3)OCCO4

InChI

InChI=1S/C17H23N3O6S/c21-20(22)14-3-4-15(16(13-14)27(23,24)19-7-1-2-8-19)18-9-5-17(6-10-18)25-11-12-26-17/h3-4,13H,1-2,5-12H2