[2-azanyl-2-(hydroxymethyl)-3-oxidanyl-propyl] 4-nitrobenzoate

Systemtic Name: [2-azanyl-2-(hydroxymethyl)-3-oxidanyl-propyl] 4-nitrobenzoate Openeye Name: [2-amino-3-hydroxy-2-(hydroxymethyl)propyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [2-amino-3-hydroxy-2-(hydroxymethyl)propyl] ester IUPAC Name: [2-amino-3-hydroxy-2-(hydroxymethyl)propyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (2-amino-3-hydroxy-2-methylol-propyl) ester Formula: C11H14N2O6 MolecularWeight: 270.23866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(CO)(CO)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(CO)(CO)N)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O6/c12-11(5-14,6-15)7-19-10(16)8-1-3-9(4-2-8)13(17)18/h1-4,14-15H,5-7,12H2