methyl 2-[(4-nitro-5-propan-2-yl-1,2-oxazol-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(4-nitro-5-propan-2-yl-1,2-oxazol-3-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(5-isopropyl-4-nitro-isoxazole-3-carbonyl)amino]benzoate CAS Name: 2-[[(4-nitro-5-propan-2-yl-3-isoxazolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-nitro-5-propan-2-yl-1,2-oxazole-3-carbonyl)amino]benzoate Traditional Name: 2-[(5-isopropyl-4-nitro-isoxazole-3-carbonyl)amino]benzoic acid methyl ester Formula: C15H15N3O6 MolecularWeight: 333.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NO1)C(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=NO1)C(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O6/c1-8(2)13-12(18(21)22)11(17-24-13)14(19)16-10-7-5-4-6-9(10)15(20)23-3/h4-8H,1-3H3,(H,16,19)