4-[3-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]propyl]morpholin-4-ium

Systemtic Name: 4-[3-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]propyl]morpholin-4-ium Openeye Name: 4-[3-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]propyl]morpholin-4-ium CAS Name: 4-[3-[3-[3-(5-pyrimidinyl)phenyl]-1-pyrazolyl]propyl]morpholin-4-ium IUPAC Name: 4-[3-[3-(3-pyrimidin-5-ylphenyl)pyrazol-1-yl]propyl]morpholin-4-ium Traditional Name: 4-[3-[3-[3-(5-pyrimidyl)phenyl]pyrazol-1-yl]propyl]morpholin-4-ium Formula: C20H24N5O+ MolecularWeight: 350.43746

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CN=C4

Isomeric SMILES

C1COCC[NH+]1CCCN2C=CC(=N2)C3=CC=CC(=C3)C4=CN=CN=C4

InChI

InChI=1S/C20H23N5O/c1-3-17(19-14-21-16-22-15-19)13-18(4-1)20-5-8-25(23-20)7-2-6-24-9-11-26-12-10-24/h1,3-5,8,13-16H,2,6-7,9-12H2/p+1