N-(furan-2-ylmethyl)-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-(furan-2-ylmethyl)-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-(2-furylmethyl)-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-(2-furanylmethyl)-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-(furan-2-ylmethyl)-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-(2-furfuryl)-4-(methylthio)-3-nitro-benzamide Formula: C13H12N2O4S MolecularWeight: 292.31038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NCC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NCC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O4S/c1-20-12-5-4-9(7-11(12)15(17)18)13(16)14-8-10-3-2-6-19-10/h2-7H,8H2,1H3,(H,14,16)