(3-chloranyl-4,5-diethoxy-phenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium

Systemtic Name: (3-chloranyl-4,5-diethoxy-phenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Openeye Name: (3-chloro-4,5-diethoxy-phenyl)methyl-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium CAS Name: (3-chloro-4,5-diethoxyphenyl)methyl-[[(2R)-2-oxolanyl]methyl]ammonium IUPAC Name: (3-chloro-4,5-diethoxyphenyl)methyl-[[(2R)-oxolan-2-yl]methyl]azanium Traditional Name: (3-chloro-4,5-diethoxy-benzyl)-[[(2R)-tetrahydrofuran-2-yl]methyl]ammonium Formula: C16H25ClNO3+ MolecularWeight: 314.8276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CC2CCCO2)Cl)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]C[C@H]2CCCO2)Cl)OCC

InChI

InChI=1S/C16H24ClNO3/c1-3-19-15-9-12(8-14(17)16(15)20-4-2)10-18-11-13-6-5-7-21-13/h8-9,13,18H,3-7,10-11H2,1-2H3/p+1/t13-/m1/s1