(3-methoxy-4-phenethyloxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: (3-methoxy-4-phenethyloxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (2-hydroxy-1,1-dimethyl-ethyl)-[(3-methoxy-4-phenethyloxy-phenyl)methyl]ammonium CAS Name: (1-hydroxy-2-methylpropan-2-yl)-[(3-methoxy-4-phenethyloxyphenyl)methyl]ammonium IUPAC Name: (1-hydroxy-2-methylpropan-2-yl)-[(3-methoxy-4-phenethyloxyphenyl)methyl]azanium Traditional Name: (2-hydroxy-1,1-dimethyl-ethyl)-(3-methoxy-4-phenethyloxy-benzyl)ammonium Formula: C20H28NO3+ MolecularWeight: 330.44122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)[NH2+]CC1=CC(=C(C=C1)OCCC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)(CO)[NH2+]CC1=CC(=C(C=C1)OCCC2=CC=CC=C2)OC

InChI

InChI=1S/C20H27NO3/c1-20(2,15-22)21-14-17-9-10-18(19(13-17)23-3)24-12-11-16-7-5-4-6-8-16/h4-10,13,21-22H,11-12,14-15H2,1-3H3/p+1