(2-bromanyl-4-methyl-phenyl) 2-nitrobenzoate

Systemtic Name: (2-bromanyl-4-methyl-phenyl) 2-nitrobenzoate Openeye Name: (2-bromo-4-methyl-phenyl) 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid (2-bromo-4-methylphenyl) ester IUPAC Name: (2-bromo-4-methylphenyl) 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid (2-bromo-4-methyl-phenyl) ester Formula: C14H10BrNO4 MolecularWeight: 336.1375

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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