N-methyl-N-[2-(2-methylphenoxy)ethyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-methyl-N-[2-(2-methylphenoxy)ethyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-methyl-N-[2-(2-methylphenoxy)ethyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-methyl-N-[2-(2-methylphenoxy)ethyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-methyl-N-[2-(2-methylphenoxy)ethyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-methyl-[2-(2-methylphenoxy)ethyl]amine Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCN(C)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCCN(C)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O5S/c1-13-6-4-5-7-17(13)24-11-10-18(2)15-9-8-14(25(3,22)23)12-16(15)19(20)21/h4-9,12H,10-11H2,1-3H3