methyl-[(2-nitrophenyl)methyl]-bis(2-oxidanylpropyl)azanium chloride

Systemtic Name: methyl-[(2-nitrophenyl)methyl]-bis(2-oxidanylpropyl)azanium chloride Openeye Name: bis(2-hydroxypropyl)-methyl-[(2-nitrophenyl)methyl]ammonium chloride CAS Name: bis(2-hydroxypropyl)-methyl-[(2-nitrophenyl)methyl]ammonium chloride IUPAC Name: bis(2-hydroxypropyl)-methyl-[(2-nitrophenyl)methyl]azanium chloride Traditional Name: bis(2-hydroxypropyl)-methyl-(2-nitrobenzyl)ammonium chloride Formula: C14H23ClN2O4 MolecularWeight: 318.79642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+](C)(CC1=CC=CC=C1[N+](=O)[O-])CC(C)O)O.[Cl-]

Isomeric SMILES

CC(C[N+](C)(CC1=CC=CC=C1[N+](=O)[O-])CC(C)O)O.[Cl-]

InChI

InChI=1S/C14H23N2O4.ClH/c1-11(17)8-16(3,9-12(2)18)10-13-6-4-5-7-14(13)15(19)20;/h4-7,11-12,17-18H,8-10H2,1-3H3;1H/q+1;/p-1