N-(2-methoxyethyl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(2-methoxyethyl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(2-methoxyethyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(2-methoxyethyl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(2-methoxyethyl)-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-(2-methoxyethyl)amine Formula: C10H14N2O5S MolecularWeight: 274.29356

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C10H14N2O5S/c1-17-6-5-11-9-4-3-8(18(2,15)16)7-10(9)12(13)14/h3-4,7,11H,5-6H2,1-2H3