1-(5-methyl-2-nitro-phenoxy)-3-(propan-2-ylamino)propan-2-ol hydrochloride

Systemtic Name: 1-(5-methyl-2-nitro-phenoxy)-3-(propan-2-ylamino)propan-2-ol hydrochloride Openeye Name: 1-(isopropylamino)-3-(5-methyl-2-nitro-phenoxy)propan-2-ol hydrochloride CAS Name: 1-(5-methyl-2-nitrophenoxy)-3-(propan-2-ylamino)-2-propanol hydrochloride IUPAC Name: 1-(5-methyl-2-nitrophenoxy)-3-(propan-2-ylamino)propan-2-ol hydrochloride Traditional Name: 1-(isopropylamino)-3-(5-methyl-2-nitro-phenoxy)propan-2-ol hydrochloride Formula: C13H21ClN2O4 MolecularWeight: 304.76984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4.ClH/c1-9(2)14-7-11(16)8-19-13-6-10(3)4-5-12(13)15(17)18;/h4-6,9,11,14,16H,7-8H2,1-3H3;1H