[(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-(quinolin-5-ylmethyl)azanium

Systemtic Name: [(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-(quinolin-5-ylmethyl)azanium Openeye Name: [(4R)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]-(5-quinolylmethyl)ammonium CAS Name: [(4R)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]-(5-quinolinylmethyl)ammonium IUPAC Name: [(4R)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]-(quinolin-5-ylmethyl)azanium Traditional Name: [(4R)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]-(5-quinolylmethyl)ammonium Formula: C22H22N5+ MolecularWeight: 356.44358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=C5C=CC=NC5=CC=C4

Isomeric SMILES

C1C[C@H](C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=C5C=CC=NC5=CC=C4

InChI

InChI=1S/C22H21N5/c1-2-12-24-22(11-1)27-21-10-4-9-20(18(21)15-26-27)25-14-16-6-3-8-19-17(16)7-5-13-23-19/h1-3,5-8,11-13,15,20,25H,4,9-10,14H2/p+1/t20-/m1/s1