[(2R)-3-(2,3-dihydro-1H-inden-5-yloxy)-2-oxidanyl-propyl]-phenethyl-azanium

Systemtic Name: [(2R)-3-(2,3-dihydro-1H-inden-5-yloxy)-2-oxidanyl-propyl]-phenethyl-azanium Openeye Name: [(2R)-2-hydroxy-3-indan-5-yloxy-propyl]-phenethyl-ammonium CAS Name: [(2R)-3-(2,3-dihydro-1H-inden-5-yloxy)-2-hydroxypropyl]-phenethylammonium IUPAC Name: [(2R)-3-(2,3-dihydro-1H-inden-5-yloxy)-2-hydroxypropyl]-phenethylazanium Traditional Name: [(2R)-2-hydroxy-3-indan-5-yloxy-propyl]-phenethyl-ammonium Formula: C20H26NO2+ MolecularWeight: 312.42594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)OCC(C[NH2+]CCC3=CC=CC=C3)O

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)OC[C@@H](C[NH2+]CCC3=CC=CC=C3)O

InChI

InChI=1S/C20H25NO2/c22-19(14-21-12-11-16-5-2-1-3-6-16)15-23-20-10-9-17-7-4-8-18(17)13-20/h1-3,5-6,9-10,13,19,21-22H,4,7-8,11-12,14-15H2/p+1/t19-/m1/s1