(5-methyl-1,2-oxazol-3-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate Openeye Name: (5-methylisoxazol-3-yl)methyl 2-(2-methoxyethylamino)-5-nitro-benzoate CAS Name: 2-(2-methoxyethylamino)-5-nitrobenzoic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-(2-methoxyethylamino)-5-nitrobenzoate Traditional Name: 2-(2-methoxyethylamino)-5-nitro-benzoic acid (5-methylisoxazol-3-yl)methyl ester Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC

Isomeric SMILES

CC1=CC(=NO1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCOC

InChI

InChI=1S/C15H17N3O6/c1-10-7-11(17-24-10)9-23-15(19)13-8-12(18(20)21)3-4-14(13)16-5-6-22-2/h3-4,7-8,16H,5-6,9H2,1-2H3