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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-propyl-4-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-propylpyrazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-5-propyl-pyrazole-4-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H21N3O3/c1-2-6-18-17(14-22-24(18)16-7-4-3-5-8-16)21(25)23-15-9-10-19-20(13-15)27-12-11-26-19/h3-5,7-10,13-14H,2,6,11-12H2,1H3,(H,23,25)