N-(4-acetamido-5-nitro-2-sulfanyl-phenyl)ethanamide; ethanol

Systemtic Name: N-(4-acetamido-5-nitro-2-sulfanyl-phenyl)ethanamide; ethanol Openeye Name: N-(4-acetamido-5-nitro-2-sulfanyl-phenyl)acetamide; ethanol CAS Name: N-(4-acetamido-2-mercapto-5-nitrophenyl)acetamide; ethanol IUPAC Name: N-(4-acetamido-5-nitro-2-sulfanylphenyl)acetamide; ethanol Traditional Name: N-(4-acetamido-2-mercapto-5-nitro-phenyl)acetamide; ethanol Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

CCO.CC(=O)NC1=CC(=C(C=C1S)NC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCO.CC(=O)NC1=CC(=C(C=C1S)NC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C10H11N3O4S.C2H6O/c1-5(14)11-7-4-10(18)8(12-6(2)15)3-9(7)13(16)17;1-2-3/h3-4,18H,1-2H3,(H,11,14)(H,12,15);3H,2H2,1H3