(6-chloranylquinolin-2-yl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium

Systemtic Name: (6-chloranylquinolin-2-yl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Openeye Name: (6-chloro-2-quinolyl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium CAS Name: (6-chloro-2-quinolinyl)methyl-[(4S)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium IUPAC Name: (6-chloroquinolin-2-yl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Traditional Name: (6-chloro-2-quinolyl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium Formula: C22H21ClN5+ MolecularWeight: 390.88864

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=NC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

C1C[C@@H](C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=NC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C22H20ClN5/c23-16-8-10-19-15(12-16)7-9-17(27-19)13-25-20-4-3-5-21-18(20)14-26-28(21)22-6-1-2-11-24-22/h1-2,6-12,14,20,25H,3-5,13H2/p+1/t20-/m0/s1