[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 1,3-benzoxazole-6-carboxylate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 1,3-benzoxazole-6-carboxylate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 1,3-benzoxazole-6-carboxylate CAS Name: 1,3-benzoxazole-6-carboxylic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 1,3-benzoxazole-6-carboxylate Traditional Name: 1,3-benzoxazole-6-carboxylic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C16H10N2O6 MolecularWeight: 326.2604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC3=C(C=C2)N=CO3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)COC(=O)C2=CC3=C(C=C2)N=CO3

InChI

InChI=1S/C16H10N2O6/c19-14(10-2-1-3-12(6-10)18(21)22)8-23-16(20)11-4-5-13-15(7-11)24-9-17-13/h1-7,9H,8H2