[2-nitro-4-[2-(propan-2-ylamino)ethanoyl]phenyl] ethanoate

Systemtic Name: [2-nitro-4-[2-(propan-2-ylamino)ethanoyl]phenyl] ethanoate Openeye Name: [4-[2-(isopropylamino)acetyl]-2-nitro-phenyl] acetate CAS Name: acetic acid [2-nitro-4-[1-oxo-2-(propan-2-ylamino)ethyl]phenyl] ester IUPAC Name: [2-nitro-4-[2-(propan-2-ylamino)acetyl]phenyl] acetate Traditional Name: acetic acid [4-[2-(isopropylamino)acetyl]-2-nitro-phenyl] ester Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(=O)C1=CC(=C(C=C1)OC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)NCC(=O)C1=CC(=C(C=C1)OC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H16N2O5/c1-8(2)14-7-12(17)10-4-5-13(20-9(3)16)11(6-10)15(18)19/h4-6,8,14H,7H2,1-3H3