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

Systemtic Name: cyclohexylmethyl 2-(4-chloranyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: cyclohexylmethyl 2-(4-chloro-3-nitro-benzoyl)benzoate CAS Name: 2-[(4-chloro-3-nitrophenyl)-oxomethyl]benzoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 2-(4-chloro-3-nitrobenzoyl)benzoate Traditional Name: 2-(4-chloro-3-nitro-benzoyl)benzoic acid cyclohexylmethyl ester Formula: C21H20ClNO5 MolecularWeight: 401.8402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)COC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)COC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClNO5/c22-18-11-10-15(12-19(18)23(26)27)20(24)16-8-4-5-9-17(16)21(25)28-13-14-6-2-1-3-7-14/h4-5,8-12,14H,1-3,6-7,13H2