N-[2-(3,4-diethoxyphenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: 2-(3,4-diethoxyphenyl)ethyl-(4-mesyl-2-nitro-phenyl)amine Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C19H24N2O6S/c1-4-26-18-9-6-14(12-19(18)27-5-2)10-11-20-16-8-7-15(28(3,24)25)13-17(16)21(22)23/h6-9,12-13,20H,4-5,10-11H2,1-3H3