[4-bromanyl-2-(2-nitroprop-1-enyl)phenyl] 2,4-bis(chloranyl)benzoate

Systemtic Name: [4-bromanyl-2-(2-nitroprop-1-enyl)phenyl] 2,4-bis(chloranyl)benzoate Openeye Name: [4-bromo-2-(2-nitroprop-1-enyl)phenyl] 2,4-dichlorobenzoate CAS Name: 2,4-dichlorobenzoic acid [4-bromo-2-(2-nitroprop-1-enyl)phenyl] ester IUPAC Name: [4-bromo-2-(2-nitroprop-1-enyl)phenyl] 2,4-dichlorobenzoate Traditional Name: 2,4-dichlorobenzoic acid [4-bromo-2-(2-nitroprop-1-enyl)phenyl] ester Formula: C16H10BrCl2NO4 MolecularWeight: 431.0649

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10BrCl2NO4/c1-9(20(22)23)6-10-7-11(17)2-5-15(10)24-16(21)13-4-3-12(18)8-14(13)19/h2-8H,1H3