2-methyl-5-[2-[4-[(3-pyrazol-1-ylphenyl)methylidene]piperidin-1-yl]ethoxy]quinoline

Systemtic Name: 2-methyl-5-[2-[4-[(3-pyrazol-1-ylphenyl)methylidene]piperidin-1-yl]ethoxy]quinoline Openeye Name: 2-methyl-5-[2-[4-[(3-pyrazol-1-ylphenyl)methylene]-1-piperidyl]ethoxy]quinoline CAS Name: 2-methyl-5-[2-[4-[[3-(1-pyrazolyl)phenyl]methylidene]-1-piperidinyl]ethoxy]quinoline IUPAC Name: 2-methyl-5-[2-[4-[(3-pyrazol-1-ylphenyl)methylidene]piperidin-1-yl]ethoxy]quinoline Traditional Name: 2-methyl-5-[2-[4-(3-pyrazol-1-ylbenzylidene)piperidino]ethoxy]quinoline Formula: C27H28N4O MolecularWeight: 424.53742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC=C2)OCCN3CCC(=CC4=CC(=CC=C4)N5C=CC=N5)CC3

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC=C2)OCCN3CCC(=CC4=CC(=CC=C4)N5C=CC=N5)CC3

InChI

InChI=1S/C27H28N4O/c1-21-9-10-25-26(29-21)7-3-8-27(25)32-18-17-30-15-11-22(12-16-30)19-23-5-2-6-24(20-23)31-14-4-13-28-31/h2-10,13-14,19-20H,11-12,15-18H2,1H3