4-[(4-bromanylpyrazol-1-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide

Systemtic Name: 4-[(4-bromanylpyrazol-1-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Openeye Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide CAS Name: 4-[(4-bromo-1-pyrazolyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide IUPAC Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Traditional Name: 4-[(4-bromopyrazol-1-yl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Formula: C19H16BrN3O3 MolecularWeight: 414.25264

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=C(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C19H16BrN3O3/c20-15-10-21-23(12-15)11-13-1-3-14(4-2-13)19(24)22-16-5-6-17-18(9-16)26-8-7-25-17/h1-6,9-10,12H,7-8,11H2,(H,22,24)