(4-phenylmethoxycarbonylphenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (4-phenylmethoxycarbonylphenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (4-benzyloxycarbonylphenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (4-phenylmethoxycarbonylphenyl) ester IUPAC Name: (4-phenylmethoxycarbonylphenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid (4-carbobenzoxyphenyl) ester Formula: C21H14ClNO6 MolecularWeight: 411.79196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClNO6/c22-18-11-8-16(12-19(18)23(26)27)21(25)29-17-9-6-15(7-10-17)20(24)28-13-14-4-2-1-3-5-14/h1-12H,13H2