N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-nitro-benzamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-nitro-benzamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-4-nitro-benzamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-4-nitrobenzamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-nitrobenzamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-4-nitro-benzamide Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)CSCCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

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