methyl 3-[(2-methoxy-5-nitro-phenyl)methyl]-2-oxidanylidene-1,3-benzoxazole-5-carboxylate

Systemtic Name: methyl 3-[(2-methoxy-5-nitro-phenyl)methyl]-2-oxidanylidene-1,3-benzoxazole-5-carboxylate Openeye Name: methyl 3-[(2-methoxy-5-nitro-phenyl)methyl]-2-oxo-1,3-benzoxazole-5-carboxylate CAS Name: 3-[(2-methoxy-5-nitrophenyl)methyl]-2-oxo-1,3-benzoxazole-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[(2-methoxy-5-nitrophenyl)methyl]-2-oxo-1,3-benzoxazole-5-carboxylate Traditional Name: 2-keto-3-(2-methoxy-5-nitro-benzyl)-1,3-benzoxazole-5-carboxylic acid methyl ester Formula: C17H14N2O7 MolecularWeight: 358.30226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])CN2C3=C(C=CC(=C3)C(=O)OC)OC2=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])CN2C3=C(C=CC(=C3)C(=O)OC)OC2=O

InChI

InChI=1S/C17H14N2O7/c1-24-14-6-4-12(19(22)23)7-11(14)9-18-13-8-10(16(20)25-2)3-5-15(13)26-17(18)21/h3-8H,9H2,1-2H3