ethyl 4-[(4-methylsulfanyl-3-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(4-methylsulfanyl-3-nitro-phenyl)carbonylamino]benzoate Openeye Name: ethyl 4-[(4-methylsulfanyl-3-nitro-benzoyl)amino]benzoate CAS Name: 4-[[[4-(methylthio)-3-nitrophenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-methylsulfanyl-3-nitrobenzoyl)amino]benzoate Traditional Name: 4-[[4-(methylthio)-3-nitro-benzoyl]amino]benzoic acid ethyl ester Formula: C17H16N2O5S MolecularWeight: 360.38434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C17H16N2O5S/c1-3-24-17(21)11-4-7-13(8-5-11)18-16(20)12-6-9-15(25-2)14(10-12)19(22)23/h4-10H,3H2,1-2H3,(H,18,20)