[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2-methylpentanoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 2-methylpentanoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 2-methylpentanoate CAS Name: 2-methylpentanoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 2-methylpentanoate Traditional Name: 2-methylvaleric acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO5/c1-3-5-10(2)14(17)20-9-13(16)11-6-4-7-12(8-11)15(18)19/h4,6-8,10H,3,5,9H2,1-2H3