2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-5-nitro-benzenecarbonitrile Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-5-nitro-benzonitrile CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-5-nitrobenzonitrile IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-5-nitrobenzonitrile Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-5-nitro-benzonitrile Formula: C15H10N2O4S MolecularWeight: 314.3159

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H10N2O4S/c16-9-10-7-11(17(18)19)1-4-15(10)22-12-2-3-13-14(8-12)21-6-5-20-13/h1-4,7-8H,5-6H2