(3-methyl-4-nitro-phenyl) 2-bromanylbenzoate

Systemtic Name: (3-methyl-4-nitro-phenyl) 2-bromanylbenzoate Openeye Name: (3-methyl-4-nitro-phenyl) 2-bromobenzoate CAS Name: 2-bromobenzoic acid (3-methyl-4-nitrophenyl) ester IUPAC Name: (3-methyl-4-nitrophenyl) 2-bromobenzoate Traditional Name: 2-bromobenzoic acid (3-methyl-4-nitro-phenyl) ester Formula: C14H10BrNO4 MolecularWeight: 336.1375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(=O)C2=CC=CC=C2Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC(=O)C2=CC=CC=C2Br)[N+](=O)[O-]

InChI

InChI=1S/C14H10BrNO4/c1-9-8-10(6-7-13(9)16(18)19)20-14(17)11-4-2-3-5-12(11)15/h2-8H,1H3