N,N-diethyl-4-[2-(1H-indol-3-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[2-(1H-indol-3-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[2-(1H-indol-3-yl)-2-oxo-ethoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[2-(1H-indol-3-yl)-2-oxoethoxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[2-(1H-indol-3-yl)-2-oxoethoxy]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[2-(1H-indol-3-yl)-2-keto-ethoxy]-3-nitro-benzenesulfonamide Formula: C20H21N3O6S MolecularWeight: 431.46224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC(=O)C2=CNC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC(=O)C2=CNC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O6S/c1-3-22(4-2)30(27,28)14-9-10-20(18(11-14)23(25)26)29-13-19(24)16-12-21-17-8-6-5-7-15(16)17/h5-12,21H,3-4,13H2,1-2H3