[(1S)-1-(4-propan-2-yloxyphenyl)ethyl]-prop-2-ynyl-azanium

Systemtic Name: [(1S)-1-(4-propan-2-yloxyphenyl)ethyl]-prop-2-ynyl-azanium Openeye Name: [(1S)-1-(4-isopropoxyphenyl)ethyl]-prop-2-ynyl-ammonium CAS Name: [(1S)-1-(4-propan-2-yloxyphenyl)ethyl]-prop-2-ynylammonium IUPAC Name: [(1S)-1-(4-propan-2-yloxyphenyl)ethyl]-prop-2-ynylazanium Traditional Name: [(1S)-1-(4-isopropoxyphenyl)ethyl]-propargyl-ammonium Formula: C14H20NO+ MolecularWeight: 218.3147

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C)[NH2+]CC#C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC(C)C)[NH2+]CC#C

InChI

InChI=1S/C14H19NO/c1-5-10-15-12(4)13-6-8-14(9-7-13)16-11(2)3/h1,6-9,11-12,15H,10H2,2-4H3/p+1/t12-/m0/s1