[(2R)-4-acetamido-2-methyl-2-oxidanyl-butyl] 4-nitrobenzoate

Systemtic Name: [(2R)-4-acetamido-2-methyl-2-oxidanyl-butyl] 4-nitrobenzoate Openeye Name: [(2R)-4-acetamido-2-hydroxy-2-methyl-butyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2R)-4-acetamido-2-hydroxy-2-methylbutyl] ester IUPAC Name: [(2R)-4-acetamido-2-hydroxy-2-methylbutyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2R)-4-acetamido-2-hydroxy-2-methyl-butyl] ester Formula: C14H18N2O6 MolecularWeight: 310.30252

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC(C)(COC(=O)C1=CC=C(C=C1)[N+](=O)[O-])O

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O6/c1-10(17)15-8-7-14(2,19)9-22-13(18)11-3-5-12(6-4-11)16(20)21/h3-6,19H,7-9H2,1-2H3,(H,15,17)/t14-/m1/s1