(4-dimethylaminophenyl)methyl-[2-(3-propan-2-ylphenoxy)ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-[2-(3-propan-2-ylphenoxy)ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-[2-(3-isopropylphenoxy)ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-[2-(3-propan-2-ylphenoxy)ethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-[2-(3-propan-2-ylphenoxy)ethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-[2-(3-isopropylphenoxy)ethyl]ammonium Formula: C20H29N2O+ MolecularWeight: 313.45706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OCC[NH2+]CC2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OCC[NH2+]CC2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C20H28N2O/c1-16(2)18-6-5-7-20(14-18)23-13-12-21-15-17-8-10-19(11-9-17)22(3)4/h5-11,14,16,21H,12-13,15H2,1-4H3/p+1