N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-[2-(2-methoxy-5-methyl-phenyl)ethyl]amine Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

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