4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCC3(CC2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)N2CCC3(CC2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O6S/c1-3-19(4-2)27(23,24)14-5-6-15(16(13-14)20(21)22)18-9-7-17(8-10-18)25-11-12-26-17/h5-6,13H,3-4,7-12H2,1-2H3