N-(3-chloranyl-4-methoxy-phenyl)-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-(N-methylsulfonyl-3-nitro-anilino)acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-(N-methylsulfonyl-3-nitroanilino)acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(N-methylsulfonyl-3-nitroanilino)acetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-(N-mesyl-3-nitro-anilino)acetamide Formula: C16H16ClN3O6S MolecularWeight: 413.83274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16ClN3O6S/c1-26-15-7-6-11(8-14(15)17)18-16(21)10-19(27(2,24)25)12-4-3-5-13(9-12)20(22)23/h3-9H,10H2,1-2H3,(H,18,21)