(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (3-bromo-4-ethoxy-5-methoxy-phenyl)methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (3-bromo-4-ethoxy-5-methoxy-benzyl)-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C14H23BrNO3+ MolecularWeight: 333.24132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C[NH2+]C(C)(C)CO)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C[NH2+]C(C)(C)CO)OC

InChI

InChI=1S/C14H22BrNO3/c1-5-19-13-11(15)6-10(7-12(13)18-4)8-16-14(2,3)9-17/h6-7,16-17H,5,8-9H2,1-4H3/p+1