(3-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methyl-(2-hydroxyethyl)azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methyl-(2-hydroxyethyl)azanium Openeye Name: (3-bromo-5-ethoxy-4-isopropoxy-phenyl)methyl-(2-hydroxyethyl)ammonium CAS Name: (3-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methyl-(2-hydroxyethyl)ammonium IUPAC Name: (3-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methyl-(2-hydroxyethyl)azanium Traditional Name: (3-bromo-5-ethoxy-4-isopropoxy-benzyl)-(2-hydroxyethyl)ammonium Formula: C14H23BrNO3+ MolecularWeight: 333.24132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCO)Br)OC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCO)Br)OC(C)C

InChI

InChI=1S/C14H22BrNO3/c1-4-18-13-8-11(9-16-5-6-17)7-12(15)14(13)19-10(2)3/h7-8,10,16-17H,4-6,9H2,1-3H3/p+1