3-oxidanylpropyl-[[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]methyl]azanium

Systemtic Name: 3-oxidanylpropyl-[[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]methyl]azanium Openeye Name: 3-hydroxypropyl-[[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]methyl]ammonium CAS Name: 3-hydroxypropyl-[[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]methyl]ammonium IUPAC Name: 3-hydroxypropyl-[[3-[3-(1H-pyrazol-5-yl)phenyl]phenyl]methyl]azanium Traditional Name: 3-hydroxypropyl-[3-[3-(1H-pyrazol-5-yl)phenyl]benzyl]ammonium Formula: C19H22N3O+ MolecularWeight: 308.39748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C[NH2+]CCCO)C2=CC(=CC=C2)C3=CC=NN3

Isomeric SMILES

C1=CC(=CC(=C1)C[NH2+]CCCO)C2=CC(=CC=C2)C3=CC=NN3

InChI

InChI=1S/C19H21N3O/c23-11-3-9-20-14-15-4-1-5-16(12-15)17-6-2-7-18(13-17)19-8-10-21-22-19/h1-2,4-8,10,12-13,20,23H,3,9,11,14H2,(H,21,22)/p+1