N,N-diethyl-4-[2-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[2-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethoxy]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[2-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethoxy]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethoxy]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[2-[1-(2-methoxyethyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethoxy]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[2-keto-2-[1-(2-methoxyethyl)-2,5-dimethyl-pyrrol-3-yl]ethoxy]-3-nitro-benzenesulfonamide Formula: C21H29N3O7S MolecularWeight: 467.53586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O7S/c1-6-22(7-2)32(28,29)17-8-9-21(19(13-17)24(26)27)31-14-20(25)18-12-15(3)23(16(18)4)10-11-30-5/h8-9,12-13H,6-7,10-11,14H2,1-5H3