3-nitro-4-(1,2,4-triazol-1-yl)benzaldehyde

Systemtic Name: 3-nitro-4-(1,2,4-triazol-1-yl)benzaldehyde Openeye Name: 3-nitro-4-(1,2,4-triazol-1-yl)benzaldehyde CAS Name: 3-nitro-4-(1,2,4-triazol-1-yl)benzaldehyde IUPAC Name: 3-nitro-4-(1,2,4-triazol-1-yl)benzaldehyde Traditional Name: 3-nitro-4-(1,2,4-triazol-1-yl)benzaldehyde Formula: C9H6N4O3 MolecularWeight: 218.16894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=O)[N+](=O)[O-])N2C=NC=N2

Isomeric SMILES

C1=CC(=C(C=C1C=O)[N+](=O)[O-])N2C=NC=N2

InChI

InChI=1S/C9H6N4O3/c14-4-7-1-2-8(9(3-7)13(15)16)12-6-10-5-11-12/h1-6H