(4-chloranyl-3,5-dimethyl-phenyl) 3-nitrobenzoate

Systemtic Name: (4-chloranyl-3,5-dimethyl-phenyl) 3-nitrobenzoate Openeye Name: (4-chloro-3,5-dimethyl-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (4-chloro-3,5-dimethylphenyl) ester IUPAC Name: (4-chloro-3,5-dimethylphenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-chloro-3,5-dimethyl-phenyl) ester Formula: C15H12ClNO4 MolecularWeight: 305.71308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO4/c1-9-6-13(7-10(2)14(9)16)21-15(18)11-4-3-5-12(8-11)17(19)20/h3-8H,1-2H3