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

Systemtic Name: (3-nitrophenyl)methyl 3-bromanyl-4-methyl-benzoate Openeye Name: (3-nitrophenyl)methyl 3-bromo-4-methyl-benzoate CAS Name: 3-bromo-4-methylbenzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 3-bromo-4-methylbenzoate Traditional Name: 3-bromo-4-methyl-benzoic acid (3-nitrobenzyl) ester Formula: C15H12BrNO4 MolecularWeight: 350.16408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC2=CC(=CC=C2)[N+](=O)[O-])Br

InChI

InChI=1S/C15H12BrNO4/c1-10-5-6-12(8-14(10)16)15(18)21-9-11-3-2-4-13(7-11)17(19)20/h2-8H,9H2,1H3