4-chloranyl-2-nitro-5-(1,2,4-triazol-1-yl)aniline

Systemtic Name: 4-chloranyl-2-nitro-5-(1,2,4-triazol-1-yl)aniline Openeye Name: 4-chloro-2-nitro-5-(1,2,4-triazol-1-yl)aniline CAS Name: 4-chloro-2-nitro-5-(1,2,4-triazol-1-yl)aniline IUPAC Name: 4-chloro-2-nitro-5-(1,2,4-triazol-1-yl)aniline Traditional Name: [4-chloro-2-nitro-5-(1,2,4-triazol-1-yl)phenyl]amine Formula: C8H6ClN5O2 MolecularWeight: 239.61854

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1N)[N+](=O)[O-])Cl)N2C=NC=N2

Isomeric SMILES

C1=C(C(=CC(=C1N)[N+](=O)[O-])Cl)N2C=NC=N2

InChI

InChI=1S/C8H6ClN5O2/c9-5-1-8(14(15)16)6(10)2-7(5)13-4-11-3-12-13/h1-4H,10H2