(3-ethoxy-2-phenylmethoxy-phenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: (3-ethoxy-2-phenylmethoxy-phenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: (2-benzyloxy-3-ethoxy-phenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (3-ethoxy-2-phenylmethoxyphenyl)methyl-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: (3-ethoxy-2-phenylmethoxyphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: (2-benzoxy-3-ethoxy-benzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C21H28NO3+ MolecularWeight: 342.45192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)C[NH2+]CC3CCCO3

Isomeric SMILES

CCOC1=CC=CC(=C1OCC2=CC=CC=C2)C[NH2+]C[C@H]3CCCO3

InChI

InChI=1S/C21H27NO3/c1-2-23-20-12-6-10-18(14-22-15-19-11-7-13-24-19)21(20)25-16-17-8-4-3-5-9-17/h3-6,8-10,12,19,22H,2,7,11,13-16H2,1H3/p+1/t19-/m1/s1