1-(4-azanyl-3-nitro-phenoxy)-3-(diethylamino)propan-2-ol hydrochloride

Systemtic Name: 1-(4-azanyl-3-nitro-phenoxy)-3-(diethylamino)propan-2-ol hydrochloride Openeye Name: 1-(4-amino-3-nitro-phenoxy)-3-(diethylamino)propan-2-ol hydrochloride CAS Name: 1-(4-amino-3-nitrophenoxy)-3-(diethylamino)-2-propanol hydrochloride IUPAC Name: 1-(4-amino-3-nitrophenoxy)-3-(diethylamino)propan-2-ol hydrochloride Traditional Name: 1-(4-amino-3-nitro-phenoxy)-3-(diethylamino)propan-2-ol hydrochloride Formula: C13H22ClN3O4 MolecularWeight: 319.78448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(COC1=CC(=C(C=C1)N)[N+](=O)[O-])O.Cl

Isomeric SMILES

CCN(CC)CC(COC1=CC(=C(C=C1)N)[N+](=O)[O-])O.Cl

InChI

InChI=1S/C13H21N3O4.ClH/c1-3-15(4-2)8-10(17)9-20-11-5-6-12(14)13(7-11)16(18)19;/h5-7,10,17H,3-4,8-9,14H2,1-2H3;1H