3-nitro-4-pyridin-2-ylsulfanyl-benzaldehyde

Systemtic Name: 3-nitro-4-pyridin-2-ylsulfanyl-benzaldehyde Openeye Name: 3-nitro-4-(2-pyridylsulfanyl)benzaldehyde CAS Name: 3-nitro-4-(2-pyridinylthio)benzaldehyde IUPAC Name: 3-nitro-4-pyridin-2-ylsulfanylbenzaldehyde Traditional Name: 3-nitro-4-(2-pyridylthio)benzaldehyde Formula: C12H8N2O3S MolecularWeight: 260.26852

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=NC(=C1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O3S/c15-8-9-4-5-11(10(7-9)14(16)17)18-12-3-1-2-6-13-12/h1-8H