N,N-diethyl-4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethoxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[2-(7-ethyl-1H-indol-3-yl)-2-oxoethoxy]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[2-(7-ethyl-1H-indol-3-yl)-2-keto-ethoxy]-3-nitro-benzenesulfonamide Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC3=C(C=C(C=C3)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C22H25N3O6S/c1-4-15-8-7-9-17-18(13-23-22(15)17)20(26)14-31-21-11-10-16(12-19(21)25(27)28)32(29,30)24(5-2)6-3/h7-13,23H,4-6,14H2,1-3H3