[3-(1,3-dioxolan-2-yl)-2-nitro-propyl] benzoate

Systemtic Name: [3-(1,3-dioxolan-2-yl)-2-nitro-propyl] benzoate Openeye Name: [3-(1,3-dioxolan-2-yl)-2-nitro-propyl] benzoate CAS Name: benzoic acid [3-(1,3-dioxolan-2-yl)-2-nitropropyl] ester IUPAC Name: [3-(1,3-dioxolan-2-yl)-2-nitropropyl] benzoate Traditional Name: benzoic acid [3-(1,3-dioxolan-2-yl)-2-nitro-propyl] ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)CC(COC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1COC(O1)CC(COC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15NO6/c15-13(10-4-2-1-3-5-10)20-9-11(14(16)17)8-12-18-6-7-19-12/h1-5,11-12H,6-9H2