[4-(2-methylpropoxycarbonyl)phenyl] 3-nitrobenzoate

Systemtic Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-nitrobenzoate Openeye Name: (4-isobutoxycarbonylphenyl) 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[2-methylpropoxy(oxo)methyl]phenyl] ester IUPAC Name: [4-(2-methylpropoxycarbonyl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid (4-isobutoxycarbonylphenyl) ester Formula: C18H17NO6 MolecularWeight: 343.33068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO6/c1-12(2)11-24-17(20)13-6-8-16(9-7-13)25-18(21)14-4-3-5-15(10-14)19(22)23/h3-10,12H,11H2,1-2H3