2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-pyridin-3-yl-ethanamide

Systemtic Name: 2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]-N-pyridin-3-yl-ethanamide Openeye Name: 2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)-N-(3-pyridyl)acetamide CAS Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-(3-pyridinyl)acetamide IUPAC Name: 2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-N-pyridin-3-ylacetamide Traditional Name: 2-(N-mesyl-2-methoxy-5-nitro-anilino)-N-(3-pyridyl)acetamide Formula: C15H16N4O6S MolecularWeight: 380.37574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CN=CC=C2)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CN=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H16N4O6S/c1-25-14-6-5-12(19(21)22)8-13(14)18(26(2,23)24)10-15(20)17-11-4-3-7-16-9-11/h3-9H,10H2,1-2H3,(H,17,20)