phenyl 3-chloranyl-5-nitro-2,6-bis(oxidanyl)benzoate

Systemtic Name: phenyl 3-chloranyl-5-nitro-2,6-bis(oxidanyl)benzoate Openeye Name: phenyl 3-chloro-2,6-dihydroxy-5-nitro-benzoate CAS Name: 3-chloro-2,6-dihydroxy-5-nitrobenzoic acid phenyl ester IUPAC Name: phenyl 3-chloro-2,6-dihydroxy-5-nitrobenzoate Traditional Name: 3-chloro-2,6-dihydroxy-5-nitro-benzoic acid phenyl ester Formula: C13H8ClNO6 MolecularWeight: 309.65872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)C2=C(C(=CC(=C2O)Cl)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)C2=C(C(=CC(=C2O)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C13H8ClNO6/c14-8-6-9(15(19)20)12(17)10(11(8)16)13(18)21-7-4-2-1-3-5-7/h1-6,16-17H