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

Systemtic Name: (3-ethoxy-4-prop-2-ynoxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (3-ethoxy-4-prop-2-ynoxy-phenyl)methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: (3-ethoxy-4-prop-2-ynoxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: (3-ethoxy-4-prop-2-ynoxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (3-ethoxy-4-propargyloxy-benzyl)-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C16H24NO3+ MolecularWeight: 278.36666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO3/c1-5-9-20-14-8-7-13(10-15(14)19-6-2)11-17-16(3,4)12-18/h1,7-8,10,17-18H,6,9,11-12H2,2-4H3/p+1