[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OCC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)CC(=O)OCC(=O)NC1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-14(2,3)8-13(18)21-9-12(17)15-10-5-4-6-11(7-10)16(19)20/h4-7H,8-9H2,1-3H3,(H,15,17)