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

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-phenylbutyl)-1H-pyrazole-4-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-phenylbutyl)-1H-pyrazole-4-carboxamide CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-phenylbutyl)-1H-pyrazole-4-carboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-phenylbutyl)-1H-pyrazole-4-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(4-phenylbutyl)-1H-pyrazole-4-carboxamide Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=C(C=NN3)C(=O)NCCCCC4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=C(C=NN3)C(=O)NCCCCC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O3/c26-22(23-11-5-4-8-16-6-2-1-3-7-16)18-15-24-25-21(18)17-9-10-19-20(14-17)28-13-12-27-19/h1-3,6-7,9-10,14-15H,4-5,8,11-13H2,(H,23,26)(H,24,25)