N-tert-butyl-4-[(1-ethylpyrrolidin-2-yl)methylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[(1-ethylpyrrolidin-2-yl)methylamino]-3-nitro-benzenesulfonamide Openeye Name: N-tert-butyl-4-[(1-ethylpyrrolidin-2-yl)methylamino]-3-nitro-benzenesulfonamide CAS Name: N-tert-butyl-4-[(1-ethyl-2-pyrrolidinyl)methylamino]-3-nitrobenzenesulfonamide IUPAC Name: N-tert-butyl-4-[(1-ethylpyrrolidin-2-yl)methylamino]-3-nitrobenzenesulfonamide Traditional Name: N-tert-butyl-4-[(1-ethylpyrrolidin-2-yl)methylamino]-3-nitro-benzenesulfonamide Formula: C17H28N4O4S MolecularWeight: 384.49362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN1CCCC1CNC2=C(C=C(C=C2)S(=O)(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H28N4O4S/c1-5-20-10-6-7-13(20)12-18-15-9-8-14(11-16(15)21(22)23)26(24,25)19-17(2,3)4/h8-9,11,13,18-19H,5-7,10,12H2,1-4H3