(4-butoxyphenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium

Systemtic Name: (4-butoxyphenyl)methyl-[(3S)-2-oxidanylideneoxolan-3-yl]azanium Openeye Name: (4-butoxyphenyl)methyl-[(3S)-2-oxotetrahydrofuran-3-yl]ammonium CAS Name: (4-butoxyphenyl)methyl-[(3S)-2-oxo-3-oxolanyl]ammonium IUPAC Name: (4-butoxyphenyl)methyl-[(3S)-2-oxooxolan-3-yl]azanium Traditional Name: (4-butoxybenzyl)-[(3S)-2-ketotetrahydrofuran-3-yl]ammonium Formula: C15H22NO3+ MolecularWeight: 264.34008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C[NH2+]C2CCOC2=O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C[NH2+][C@H]2CCOC2=O

InChI

InChI=1S/C15H21NO3/c1-2-3-9-18-13-6-4-12(5-7-13)11-16-14-8-10-19-15(14)17/h4-7,14,16H,2-3,8-11H2,1H3/p+1/t14-/m0/s1