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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2,5-dimethoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2,5-dimethoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(2,5-dimethoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NN(C=C2C(=O)NCC3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NN(C=C2C(=O)NCC3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C27H25N3O5/c1-32-20-9-11-23(33-2)21(15-20)26-22(17-30(29-26)19-6-4-3-5-7-19)27(31)28-16-18-8-10-24-25(14-18)35-13-12-34-24/h3-11,14-15,17H,12-13,16H2,1-2H3,(H,28,31)