[4-(1,2,3,4-tetrazol-1-yl)phenyl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 2-chloranyl-4-nitro-benzoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C14H8ClN5O4 MolecularWeight: 345.69742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=NN=N2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1N2C=NN=N2)OC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H8ClN5O4/c15-13-7-10(20(22)23)3-6-12(13)14(21)24-11-4-1-9(2-5-11)19-8-16-17-18-19/h1-8H