5-[[[4-(4-nitrophenyl)sulfanylphenyl]amino]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[[4-(4-nitrophenyl)sulfanylphenyl]amino]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-(4-nitrophenyl)sulfanylanilino]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[(4-nitrophenyl)thio]anilino]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-(4-nitrophenyl)sulfanylanilino]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[(4-nitrophenyl)thio]anilino]methyl]-2-furoic acid Formula: C18H14N2O5S MolecularWeight: 370.37916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCC2=CC=C(O2)C(=O)O)SC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NCC2=CC=C(O2)C(=O)O)SC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O5S/c21-18(22)17-10-5-14(25-17)11-19-12-1-6-15(7-2-12)26-16-8-3-13(4-9-16)20(23)24/h1-10,19H,11H2,(H,21,22)