[3-bromanyl-1-(4-cyclopropyl-3-nitro-phenyl)propyl] ethanoate

Systemtic Name: [3-bromanyl-1-(4-cyclopropyl-3-nitro-phenyl)propyl] ethanoate Openeye Name: [3-bromo-1-(4-cyclopropyl-3-nitro-phenyl)propyl] acetate CAS Name: acetic acid [3-bromo-1-(4-cyclopropyl-3-nitrophenyl)propyl] ester IUPAC Name: [3-bromo-1-(4-cyclopropyl-3-nitrophenyl)propyl] acetate Traditional Name: acetic acid [3-bromo-1-(4-cyclopropyl-3-nitro-phenyl)propyl] ester Formula: C14H16BrNO4 MolecularWeight: 342.18514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CCBr)C1=CC(=C(C=C1)C2CC2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC(CCBr)C1=CC(=C(C=C1)C2CC2)[N+](=O)[O-]

InChI

InChI=1S/C14H16BrNO4/c1-9(17)20-14(6-7-15)11-4-5-12(10-2-3-10)13(8-11)16(18)19/h4-5,8,10,14H,2-3,6-7H2,1H3