(2-nitrophenyl) 3-bromanyl-4-methyl-benzoate

Systemtic Name: (2-nitrophenyl) 3-bromanyl-4-methyl-benzoate Openeye Name: (2-nitrophenyl) 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid (2-nitrophenyl) ester Formula: C14H10BrNO4 MolecularWeight: 336.1375

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC=C2[N+](=O)[O-])Br

InChI

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