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

Systemtic Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethyl-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethyl-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N-ethyl-3-nitro-N-phenyl-benzenesulfonamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O6S/c1-2-23(17-6-4-3-5-7-17)31(27,28)18-8-9-19(20(16-18)24(25)26)22-12-10-21(11-13-22)29-14-15-30-21/h3-9,16H,2,10-15H2,1H3