N-ethyl-3-nitro-N-phenyl-4-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: N-ethyl-3-nitro-N-phenyl-4-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: N-ethyl-3-nitro-N-phenyl-4-pyrrolidin-1-yl-benzenesulfonamide CAS Name: N-ethyl-3-nitro-N-phenyl-4-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-ethyl-3-nitro-N-phenyl-4-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: N-ethyl-3-nitro-N-phenyl-4-pyrrolidino-benzenesulfonamide Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4S/c1-2-20(15-8-4-3-5-9-15)26(24,25)16-10-11-17(18(14-16)21(22)23)19-12-6-7-13-19/h3-5,8-11,14H,2,6-7,12-13H2,1H3