(3-ethoxy-4-methoxy-phenyl)methyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: (3-ethoxy-4-methoxy-phenyl)methyl-[(2S)-pentan-2-yl]azanium Openeye Name: (3-ethoxy-4-methoxy-phenyl)methyl-[(1S)-1-methylbutyl]ammonium CAS Name: (3-ethoxy-4-methoxyphenyl)methyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: (3-ethoxy-4-methoxyphenyl)methyl-[(2S)-pentan-2-yl]azanium Traditional Name: (3-ethoxy-4-methoxy-benzyl)-[(1S)-1-methylbutyl]ammonium Formula: C15H26NO2+ MolecularWeight: 252.37244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]CC1=CC(=C(C=C1)OC)OCC

Isomeric SMILES

CCC[C@H](C)[NH2+]CC1=CC(=C(C=C1)OC)OCC

InChI

InChI=1S/C15H25NO2/c1-5-7-12(3)16-11-13-8-9-14(17-4)15(10-13)18-6-2/h8-10,12,16H,5-7,11H2,1-4H3/p+1/t12-/m0/s1