N-(3-acetamidophenyl)-4-methylsulfonyl-3-nitro-benzamide

Systemtic Name: N-(3-acetamidophenyl)-4-methylsulfonyl-3-nitro-benzamide Openeye Name: N-(3-acetamidophenyl)-4-methylsulfonyl-3-nitro-benzamide CAS Name: N-(3-acetamidophenyl)-4-methylsulfonyl-3-nitrobenzamide IUPAC Name: N-(3-acetamidophenyl)-4-methylsulfonyl-3-nitrobenzamide Traditional Name: N-(3-acetamidophenyl)-4-mesyl-3-nitro-benzamide Formula: C16H15N3O6S MolecularWeight: 377.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC(=O)C2=CC(=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O6S/c1-10(20)17-12-4-3-5-13(9-12)18-16(21)11-6-7-15(26(2,24)25)14(8-11)19(22)23/h3-9H,1-2H3,(H,17,20)(H,18,21)