2-cyclopropylpropan-2-yl 4-nitrobenzoate

Systemtic Name: 2-cyclopropylpropan-2-yl 4-nitrobenzoate Openeye Name: (1-cyclopropyl-1-methyl-ethyl) 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-cyclopropylpropan-2-yl ester IUPAC Name: 2-cyclopropylpropan-2-yl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (1-cyclopropyl-1-methyl-ethyl) ester Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1CC1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1CC1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15NO4/c1-13(2,10-5-6-10)18-12(15)9-3-7-11(8-4-9)14(16)17/h3-4,7-8,10H,5-6H2,1-2H3