3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-[2-(4-ethoxyphenoxy)propanoyl]-1-methyl-pyrazole-4-carbohydrazide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-[2-(4-ethoxyphenoxy)propanoyl]-1-methyl-pyrazole-4-carbohydrazide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-[2-(4-ethoxyphenoxy)propanoyl]-1-methyl-pyrazole-4-carbohydrazide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-[2-(4-ethoxyphenoxy)-1-oxopropyl]-1-methyl-4-pyrazolecarbohydrazide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-[2-(4-ethoxyphenoxy)propanoyl]-1-methylpyrazole-4-carbohydrazide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-[2-(4-ethoxyphenoxy)propanoyl]-1-methyl-pyrazole-4-carbohydrazide Formula: C25H28N4O6 MolecularWeight: 480.51302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC(C)C(=O)NNC(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCCO4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC(C)C(=O)NNC(=O)C2=CN(N=C2C3=CC4=C(C=C3)OCCCO4)C

InChI

InChI=1S/C25H28N4O6/c1-4-32-18-7-9-19(10-8-18)35-16(2)24(30)26-27-25(31)20-15-29(3)28-23(20)17-6-11-21-22(14-17)34-13-5-12-33-21/h6-11,14-16H,4-5,12-13H2,1-3H3,(H,26,30)(H,27,31)