[3-[2-(tert-butylamino)-1-oxidanyl-ethyl]-4-oxidanyl-phenyl]methyl nitrate

Systemtic Name: [3-[2-(tert-butylamino)-1-oxidanyl-ethyl]-4-oxidanyl-phenyl]methyl nitrate Openeye Name: [3-[2-(tert-butylamino)-1-hydroxy-ethyl]-4-hydroxy-phenyl]methyl nitrate CAS Name: nitric acid [3-[2-(tert-butylamino)-1-hydroxyethyl]-4-hydroxyphenyl]methyl ester IUPAC Name: [3-[2-(tert-butylamino)-1-hydroxyethyl]-4-hydroxyphenyl]methyl nitrate Traditional Name: nitric acid [3-[2-(tert-butylamino)-1-hydroxy-ethyl]-4-hydroxy-benzyl] ester Formula: C13H20N2O5 MolecularWeight: 284.3083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O5/c1-13(2,3)14-7-12(17)10-6-9(4-5-11(10)16)8-20-15(18)19/h4-6,12,14,16-17H,7-8H2,1-3H3