(4-bromanyl-2-propan-2-yl-phenyl) 2-(2-nitrophenoxy)ethanoate

Systemtic Name: (4-bromanyl-2-propan-2-yl-phenyl) 2-(2-nitrophenoxy)ethanoate Openeye Name: (4-bromo-2-isopropyl-phenyl) 2-(2-nitrophenoxy)acetate CAS Name: 2-(2-nitrophenoxy)acetic acid (4-bromo-2-propan-2-ylphenyl) ester IUPAC Name: (4-bromo-2-propan-2-ylphenyl) 2-(2-nitrophenoxy)acetate Traditional Name: 2-(2-nitrophenoxy)acetic acid (4-bromo-2-isopropyl-phenyl) ester Formula: C17H16BrNO5 MolecularWeight: 394.21664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)Br)OC(=O)COC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)Br)OC(=O)COC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H16BrNO5/c1-11(2)13-9-12(18)7-8-15(13)24-17(20)10-23-16-6-4-3-5-14(16)19(21)22/h3-9,11H,10H2,1-2H3