5-chloranyl-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: 5-chloranyl-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: 5-chloro-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: 5-chloro-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: 5-chloro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: 5-chloro-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C18H15ClN4O3 MolecularWeight: 370.7897

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NCC3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NCC3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C18H15ClN4O3/c19-14-9-13(10-15-16(14)26-8-7-25-15)18(24)21-11-12-3-1-4-20-17(12)23-6-2-5-22-23/h1-6,9-10H,7-8,11H2,(H,21,24)