[5-(3-hexoxyphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone

Systemtic Name: [5-(3-hexoxyphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-yl-methanone Openeye Name: [5-(3-hexoxyphenyl)-3,4-dihydropyrazol-2-yl]-(3-pyridyl)methanone CAS Name: [5-(3-hexoxyphenyl)-3,4-dihydropyrazol-2-yl]-(3-pyridinyl)methanone IUPAC Name: [5-(3-hexoxyphenyl)-3,4-dihydropyrazol-2-yl]-pyridin-3-ylmethanone Traditional Name: [3-(3-hexoxyphenyl)-2-pyrazolin-1-yl]-(3-pyridyl)methanone Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)C2=NN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-2-3-4-5-14-26-19-10-6-8-17(15-19)20-11-13-24(23-20)21(25)18-9-7-12-22-16-18/h6-10,12,15-16H,2-5,11,13-14H2,1H3