[4-tert-butyl-2,6-bis(chloranyl)phenyl] 3-nitrobenzoate

Systemtic Name: [4-tert-butyl-2,6-bis(chloranyl)phenyl] 3-nitrobenzoate Openeye Name: (4-tert-butyl-2,6-dichloro-phenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid (4-tert-butyl-2,6-dichlorophenyl) ester IUPAC Name: (4-tert-butyl-2,6-dichlorophenyl) 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-tert-butyl-2,6-dichloro-phenyl) ester Formula: C17H15Cl2NO4 MolecularWeight: 368.2113

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15Cl2NO4/c1-17(2,3)11-8-13(18)15(14(19)9-11)24-16(21)10-5-4-6-12(7-10)20(22)23/h4-9H,1-3H3