dimethyl-[2-oxidanyl-3-(4-phenylphenoxy)propyl]-propan-2-yl-azanium

Systemtic Name: dimethyl-[2-oxidanyl-3-(4-phenylphenoxy)propyl]-propan-2-yl-azanium Openeye Name: [2-hydroxy-3-(4-phenylphenoxy)propyl]-isopropyl-dimethyl-ammonium CAS Name: [2-hydroxy-3-(4-phenylphenoxy)propyl]-dimethyl-propan-2-ylammonium IUPAC Name: [2-hydroxy-3-(4-phenylphenoxy)propyl]-dimethyl-propan-2-ylazanium Traditional Name: [2-hydroxy-3-(4-phenylphenoxy)propyl]-isopropyl-dimethyl-ammonium Formula: C20H28NO2+ MolecularWeight: 314.44182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(C)CC(COC1=CC=C(C=C1)C2=CC=CC=C2)O

Isomeric SMILES

CC(C)[N+](C)(C)CC(COC1=CC=C(C=C1)C2=CC=CC=C2)O

InChI

InChI=1S/C20H28NO2/c1-16(2)21(3,4)14-19(22)15-23-20-12-10-18(11-13-20)17-8-6-5-7-9-17/h5-13,16,19,22H,14-15H2,1-4H3/q+1