5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-1H-pyrazole-4-carboxamide

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-1H-pyrazole-4-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-1H-pyrazole-4-carboxamide CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-1H-pyrazole-4-carboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-1H-pyrazole-4-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-1H-pyrazole-4-carboxamide Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=C(C=NN3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=C(C=NN3)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C20H19N3O3/c24-20(21-9-8-14-4-2-1-3-5-14)16-13-22-23-19(16)15-6-7-17-18(12-15)26-11-10-25-17/h1-7,12-13H,8-11H2,(H,21,24)(H,22,23)