propan-2-yl 3-nitrobenzoate

Systemtic Name: propan-2-yl 3-nitrobenzoate Openeye Name: isopropyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid isopropyl ester Formula: C10H11NO4 MolecularWeight: 209.19864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11NO4/c1-7(2)15-10(12)8-4-3-5-9(6-8)11(13)14/h3-7H,1-2H3