[4-[2-(2-methylpropanoylamino)ethyl]-2-nitro-phenyl] 2-methylpropanoate

Systemtic Name: [4-[2-(2-methylpropanoylamino)ethyl]-2-nitro-phenyl] 2-methylpropanoate Openeye Name: [4-[2-(2-methylpropanoylamino)ethyl]-2-nitro-phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [4-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-nitrophenyl] ester IUPAC Name: [4-[2-(2-methylpropanoylamino)ethyl]-2-nitrophenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [4-[2-(isobutyrylamino)ethyl]-2-nitro-phenyl] ester Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCC1=CC(=C(C=C1)OC(=O)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NCCC1=CC(=C(C=C1)OC(=O)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H22N2O5/c1-10(2)15(19)17-8-7-12-5-6-14(13(9-12)18(21)22)23-16(20)11(3)4/h5-6,9-11H,7-8H2,1-4H3,(H,17,19)