2-[(5-methylsulfanyl-2-nitro-phenyl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(5-methylsulfanyl-2-nitro-phenyl)carbonylamino]ethanoic acid Openeye Name: 2-[(5-methylsulfanyl-2-nitro-benzoyl)amino]acetic acid CAS Name: 2-[[[5-(methylthio)-2-nitrophenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(5-methylsulfanyl-2-nitrobenzoyl)amino]acetic acid Traditional Name: 2-[[5-(methylthio)-2-nitro-benzoyl]amino]acetic acid Formula: C10H10N2O5S MolecularWeight: 270.2618

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NCC(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NCC(=O)O

InChI

InChI=1S/C10H10N2O5S/c1-18-6-2-3-8(12(16)17)7(4-6)10(15)11-5-9(13)14/h2-4H,5H2,1H3,(H,11,15)(H,13,14)