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

Systemtic Name: (3-ethoxy-4-oxidanyl-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (3-ethoxy-4-hydroxy-phenyl)methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: (3-ethoxy-4-hydroxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: (3-ethoxy-4-hydroxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (3-ethoxy-4-hydroxy-benzyl)-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C13H22NO3+ MolecularWeight: 240.31868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C(C)(C)CO)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C(C)(C)CO)O

InChI

InChI=1S/C13H21NO3/c1-4-17-12-7-10(5-6-11(12)16)8-14-13(2,3)9-15/h5-7,14-16H,4,8-9H2,1-3H3/p+1