N,N-diethyl-3-nitro-4-[2-oxidanylidene-2-(4-propylphenyl)ethoxy]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[2-oxidanylidene-2-(4-propylphenyl)ethoxy]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[2-oxo-2-(4-propylphenyl)ethoxy]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[2-oxo-2-(4-propylphenyl)ethoxy]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[2-oxo-2-(4-propylphenyl)ethoxy]benzenesulfonamide Traditional Name: N,N-diethyl-4-[2-keto-2-(4-propylphenyl)ethoxy]-3-nitro-benzenesulfonamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C21H26N2O6S/c1-4-7-16-8-10-17(11-9-16)20(24)15-29-21-13-12-18(14-19(21)23(25)26)30(27,28)22(5-2)6-3/h8-14H,4-7,15H2,1-3H3