ethyl 3-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[(5-methylisoxazol-3-yl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(5-methyl-3-isoxazolyl)amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(5-methylisoxazol-3-yl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=NOC(=C2)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=NOC(=C2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6/c1-3-22-14(19)10-5-9(6-11(7-10)17(20)21)13(18)15-12-4-8(2)23-16-12/h4-7H,3H2,1-2H3,(H,15,16,18)