N,N-diethyl-4-methoxy-3-(5-oxidanylidene-3-propyl-4H-pyrazol-1-yl)benzenesulfonamide; 2-ethyl-3-oxidanylidene-hexanoic acid

Systemtic Name: N,N-diethyl-4-methoxy-3-(5-oxidanylidene-3-propyl-4H-pyrazol-1-yl)benzenesulfonamide; 2-ethyl-3-oxidanylidene-hexanoic acid Openeye Name: N,N-diethyl-4-methoxy-3-(5-oxo-3-propyl-4H-pyrazol-1-yl)benzenesulfonamide; 2-ethyl-3-oxo-hexanoic acid CAS Name: N,N-diethyl-4-methoxy-3-(5-oxo-3-propyl-4H-pyrazol-1-yl)benzenesulfonamide; 2-ethyl-3-oxohexanoic acid IUPAC Name: N,N-diethyl-4-methoxy-3-(5-oxo-3-propyl-4H-pyrazol-1-yl)benzenesulfonamide; 2-ethyl-3-oxohexanoic acid Traditional Name: N,N-diethyl-3-(5-keto-3-propyl-2-pyrazolin-1-yl)-4-methoxy-benzenesulfonamide; 2-ethyl-3-keto-hexanoic acid Formula: C25H39N3O7S MolecularWeight: 525.65806

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1)C2=C(C=CC(=C2)S(=O)(=O)N(CC)CC)OC.CCCC(=O)C(CC)C(=O)O

Isomeric SMILES

CCCC1=NN(C(=O)C1)C2=C(C=CC(=C2)S(=O)(=O)N(CC)CC)OC.CCCC(=O)C(CC)C(=O)O

InChI

InChI=1S/C17H25N3O4S.C8H14O3/c1-5-8-13-11-17(21)20(18-13)15-12-14(9-10-16(15)24-4)25(22,23)19(6-2)7-3;1-3-5-7(9)6(4-2)8(10)11/h9-10,12H,5-8,11H2,1-4H3;6H,3-5H2,1-2H3,(H,10,11)