methyl 3-(2-nitroethyl)-4,5-dihydro-1,2-oxazole-5-carboxylate

Systemtic Name: methyl 3-(2-nitroethyl)-4,5-dihydro-1,2-oxazole-5-carboxylate Openeye Name: methyl 3-(2-nitroethyl)-4,5-dihydroisoxazole-5-carboxylate CAS Name: 3-(2-nitroethyl)-4,5-dihydroisoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-nitroethyl)-4,5-dihydro-1,2-oxazole-5-carboxylate Traditional Name: 3-(2-nitroethyl)-2-isoxazoline-5-carboxylic acid methyl ester Formula: C7H10N2O5 MolecularWeight: 202.1647

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=NO1)CC[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CC(=NO1)CC[N+](=O)[O-]

InChI

InChI=1S/C7H10N2O5/c1-13-7(10)6-4-5(8-14-6)2-3-9(11)12/h6H,2-4H2,1H3