2-[5-(4-chloranyl-3-nitro-phenyl)-1,2,3,4-tetrazol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(4-chloranyl-3-nitro-phenyl)-1,2,3,4-tetrazol-1-yl]ethanoic acid Openeye Name: 2-[5-(4-chloro-3-nitro-phenyl)tetrazol-1-yl]acetic acid CAS Name: 2-[5-(4-chloro-3-nitrophenyl)-1-tetrazolyl]acetic acid IUPAC Name: 2-[5-(4-chloro-3-nitrophenyl)tetrazol-1-yl]acetic acid Traditional Name: 2-[5-(4-chloro-3-nitro-phenyl)tetrazol-1-yl]acetic acid Formula: C9H6ClN5O4 MolecularWeight: 283.62804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NN=NN2CC(=O)O)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=NN=NN2CC(=O)O)[N+](=O)[O-])Cl

InChI

InChI=1S/C9H6ClN5O4/c10-6-2-1-5(3-7(6)15(18)19)9-11-12-13-14(9)4-8(16)17/h1-3H,4H2,(H,16,17)