N-[4-(4-chloranylpyrazol-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[4-(4-chloranylpyrazol-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[4-(4-chloropyrazol-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[4-(4-chloro-1-pyrazolyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[4-(4-chloropyrazol-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[4-(4-chloropyrazol-1-yl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C18H14ClN3O3 MolecularWeight: 355.77506

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)N4C=C(C=N4)Cl

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NC3=CC=C(C=C3)N4C=C(C=N4)Cl

InChI

InChI=1S/C18H14ClN3O3/c19-13-10-20-22(11-13)15-4-2-14(3-5-15)21-18(23)12-1-6-16-17(9-12)25-8-7-24-16/h1-6,9-11H,7-8H2,(H,21,23)