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

Systemtic Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-ethylbenzyl)-(4-mesyl-2-nitro-phenyl)-methyl-amine Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O4S/c1-4-13-5-7-14(8-6-13)12-18(2)16-10-9-15(24(3,22)23)11-17(16)19(20)21/h5-11H,4,12H2,1-3H3