(2-propan-2-ylphenyl) 4-chloranyl-3-nitro-benzoate

Systemtic Name: (2-propan-2-ylphenyl) 4-chloranyl-3-nitro-benzoate Openeye Name: (2-isopropylphenyl) 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid (2-propan-2-ylphenyl) ester IUPAC Name: (2-propan-2-ylphenyl) 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid o-cumenyl ester Formula: C16H14ClNO4 MolecularWeight: 319.73966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1OC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H14ClNO4/c1-10(2)12-5-3-4-6-15(12)22-16(19)11-7-8-13(17)14(9-11)18(20)21/h3-10H,1-2H3