[2-[2-(4-tert-butylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-[(1R)-1-phenylethyl]azanium

Systemtic Name: [2-[2-(4-tert-butylphenoxy)ethylamino]-2-oxidanylidene-ethyl]-[(1R)-1-phenylethyl]azanium Openeye Name: [2-[2-(4-tert-butylphenoxy)ethylamino]-2-oxo-ethyl]-[(1R)-1-phenylethyl]ammonium CAS Name: [2-[2-(4-tert-butylphenoxy)ethylamino]-2-oxoethyl]-[(1R)-1-phenylethyl]ammonium IUPAC Name: [2-[2-(4-tert-butylphenoxy)ethylamino]-2-oxoethyl]-[(1R)-1-phenylethyl]azanium Traditional Name: [2-[2-(4-tert-butylphenoxy)ethylamino]-2-keto-ethyl]-[(1R)-1-phenylethyl]ammonium Formula: C22H31N2O2+ MolecularWeight: 355.49374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]CC(=O)NCCOC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)[NH2+]CC(=O)NCCOC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H30N2O2/c1-17(18-8-6-5-7-9-18)24-16-21(25)23-14-15-26-20-12-10-19(11-13-20)22(2,3)4/h5-13,17,24H,14-16H2,1-4H3,(H,23,25)/p+1/t17-/m1/s1