[4-(phenylcarbonyl)phenyl]methyl 2-chloranyl-4-nitro-benzoate

Systemtic Name: [4-(phenylcarbonyl)phenyl]methyl 2-chloranyl-4-nitro-benzoate Openeye Name: (4-benzoylphenyl)methyl 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid (4-benzoylphenyl)methyl ester IUPAC Name: (4-benzoylphenyl)methyl 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (4-benzoylbenzyl) ester Formula: C21H14ClNO5 MolecularWeight: 395.79256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H14ClNO5/c22-19-12-17(23(26)27)10-11-18(19)21(25)28-13-14-6-8-16(9-7-14)20(24)15-4-2-1-3-5-15/h1-12H,13H2