2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-propan-2-ylacetamide IUPAC Name: 2-(2-methyl-N-methylsulfonyl-5-nitroanilino)-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-(N-mesyl-2-methyl-5-nitro-anilino)acetamide Formula: C13H19N3O5S MolecularWeight: 329.37206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC(C)C)S(=O)(=O)C

InChI

InChI=1S/C13H19N3O5S/c1-9(2)14-13(17)8-15(22(4,20)21)12-7-11(16(18)19)6-5-10(12)3/h5-7,9H,8H2,1-4H3,(H,14,17)