N-(1H-pyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-(1H-pyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(1H-pyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(1H-pyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(1H-pyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(1H-pyrazol-4-yl)-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C13H13N3O3 MolecularWeight: 259.26062

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)NC3=CNN=C3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)NC3=CNN=C3)OC1

InChI

InChI=1S/C13H13N3O3/c17-13(16-10-7-14-15-8-10)9-2-3-11-12(6-9)19-5-1-4-18-11/h2-3,6-8H,1,4-5H2,(H,14,15)(H,16,17)