2-[(4-butoxy-3-nitro-phenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride

Systemtic Name: 2-[(4-butoxy-3-nitro-phenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride Openeye Name: 2-[(4-butoxy-3-nitro-phenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride CAS Name: 2-[(4-butoxy-3-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride IUPAC Name: 2-[(4-butoxy-3-nitrophenyl)methyl-(2-hydroxyethyl)amino]ethanol hydrochloride Traditional Name: 2-[(4-butoxy-3-nitro-benzyl)-(2-hydroxyethyl)amino]ethanol hydrochloride Formula: C15H25ClN2O5 MolecularWeight: 348.8224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CN(CCO)CCO)[N+](=O)[O-].Cl

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CN(CCO)CCO)[N+](=O)[O-].Cl

InChI

InChI=1S/C15H24N2O5.ClH/c1-2-3-10-22-15-5-4-13(11-14(15)17(20)21)12-16(6-8-18)7-9-19;/h4-5,11,18-19H,2-3,6-10,12H2,1H3;1H