N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-nitro-benzamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-nitro-benzamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-2-nitro-benzamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-2-nitrobenzamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-2-nitrobenzamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-2-nitro-benzamide Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCSCC2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCSCC2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O4S/c17-14(12-5-1-2-6-13(12)16(18)19)15-7-9-21-10-11-4-3-8-20-11/h1-6,8H,7,9-10H2,(H,15,17)