[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 6-acetamidohexanoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 6-acetamidohexanoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 6-acetamidohexanoate CAS Name: 6-acetamidohexanoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 6-acetamidohexanoate Traditional Name: 6-acetamidohexanoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C16H20N2O6 MolecularWeight: 336.3398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O6/c1-12(19)17-9-4-2-3-8-16(21)24-11-15(20)13-6-5-7-14(10-13)18(22)23/h5-7,10H,2-4,8-9,11H2,1H3,(H,17,19)