(2-bromanyl-4-propan-2-yl-phenyl) 4-nitrobenzoate

Systemtic Name: (2-bromanyl-4-propan-2-yl-phenyl) 4-nitrobenzoate Openeye Name: (2-bromo-4-isopropyl-phenyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (2-bromo-4-propan-2-ylphenyl) ester IUPAC Name: (2-bromo-4-propan-2-ylphenyl) 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-bromo-4-isopropyl-phenyl) ester Formula: C16H14BrNO4 MolecularWeight: 364.19066

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14BrNO4/c1-10(2)12-5-8-15(14(17)9-12)22-16(19)11-3-6-13(7-4-11)18(20)21/h3-10H,1-2H3