N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanesulfonamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanesulfonamide Openeye Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanesulfonamide CAS Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethanesulfonamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanesulfonamide Traditional Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanesulfonamide Formula: C21H32N4O6S MolecularWeight: 468.56698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C(C)C)NS(=O)(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C(C)C)NS(=O)(=O)CCN2C(=C(C(=N2)C)[N+](=O)[O-])C)OCC

InChI

InChI=1S/C21H32N4O6S/c1-7-30-18-10-9-17(13-19(18)31-8-2)20(14(3)4)23-32(28,29)12-11-24-16(6)21(25(26)27)15(5)22-24/h9-10,13-14,20,23H,7-8,11-12H2,1-6H3