3,4-diethoxy-N-(4-methylsulfonyl-2-nitro-phenyl)aniline

Systemtic Name: 3,4-diethoxy-N-(4-methylsulfonyl-2-nitro-phenyl)aniline Openeye Name: 3,4-diethoxy-N-(4-methylsulfonyl-2-nitro-phenyl)aniline CAS Name: 3,4-diethoxy-N-(4-methylsulfonyl-2-nitrophenyl)aniline IUPAC Name: 3,4-diethoxy-N-(4-methylsulfonyl-2-nitrophenyl)aniline Traditional Name: (3,4-diethoxyphenyl)-(4-mesyl-2-nitro-phenyl)amine Formula: C17H20N2O6S MolecularWeight: 380.4155

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C17H20N2O6S/c1-4-24-16-9-6-12(10-17(16)25-5-2)18-14-8-7-13(26(3,22)23)11-15(14)19(20)21/h6-11,18H,4-5H2,1-3H3