2-phenoxyethyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: 2-phenoxyethyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: 2-phenoxyethyl 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid 2-phenoxyethyl ester Formula: C22H16ClNO6 MolecularWeight: 425.81854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCOC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCOC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C22H16ClNO6/c23-19-11-10-15(14-20(19)24(27)28)21(25)17-8-4-5-9-18(17)22(26)30-13-12-29-16-6-2-1-3-7-16/h1-11,14H,12-13H2