7-chloranyl-2-[[4-(1-methyl-4-pyridin-4-yl-pyrazol-3-yl)phenoxy]methyl]quinoline hydrochloride

Systemtic Name: 7-chloranyl-2-[[4-(1-methyl-4-pyridin-4-yl-pyrazol-3-yl)phenoxy]methyl]quinoline hydrochloride Openeye Name: 7-chloro-2-[[4-[1-methyl-4-(4-pyridyl)pyrazol-3-yl]phenoxy]methyl]quinoline hydrochloride CAS Name: 7-chloro-2-[[4-(1-methyl-4-pyridin-4-yl-3-pyrazolyl)phenoxy]methyl]quinoline hydrochloride IUPAC Name: 7-chloro-2-[[4-(1-methyl-4-pyridin-4-ylpyrazol-3-yl)phenoxy]methyl]quinoline hydrochloride Traditional Name: 7-chloro-2-[[4-[1-methyl-4-(4-pyridyl)pyrazol-3-yl]phenoxy]methyl]quinoline hydrochloride Formula: C25H20Cl2N4O MolecularWeight: 463.3585

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=C(C=CC(=C4)Cl)C=C3)C5=CC=NC=C5.Cl

Isomeric SMILES

CN1C=C(C(=N1)C2=CC=C(C=C2)OCC3=NC4=C(C=CC(=C4)Cl)C=C3)C5=CC=NC=C5.Cl

InChI

InChI=1S/C25H19ClN4O.ClH/c1-30-15-23(17-10-12-27-13-11-17)25(29-30)19-4-8-22(9-5-19)31-16-21-7-3-18-2-6-20(26)14-24(18)28-21;/h2-15H,16H2,1H3;1H