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

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-nitro-benzaldehyde Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-nitro-benzaldehyde CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-nitrobenzaldehyde IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-nitrobenzaldehyde Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-nitro-benzaldehyde Formula: C15H11NO5S MolecularWeight: 317.31654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11NO5S/c17-9-10-1-4-15(12(7-10)16(18)19)22-11-2-3-13-14(8-11)21-6-5-20-13/h1-4,7-9H,5-6H2