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

Systemtic Name: (4-fluoranyl-2-methoxy-phenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Openeye Name: (4-fluoro-2-methoxy-phenyl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium CAS Name: (4-fluoro-2-methoxyphenyl)methyl-[(4S)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium IUPAC Name: (4-fluoro-2-methoxyphenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Traditional Name: (4-fluoro-2-methoxy-benzyl)-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium Formula: C20H22FN4O+ MolecularWeight: 353.413283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)F)C[NH2+]C2CCCC3=C2C=NN3C4=CC=CC=N4

Isomeric SMILES

COC1=C(C=CC(=C1)F)C[NH2+][C@H]2CCCC3=C2C=NN3C4=CC=CC=N4

InChI

InChI=1S/C20H21FN4O/c1-26-19-11-15(21)9-8-14(19)12-23-17-5-4-6-18-16(17)13-24-25(18)20-7-2-3-10-22-20/h2-3,7-11,13,17,23H,4-6,12H2,1H3/p+1/t17-/m0/s1