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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3-methoxyphenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3-methoxyphenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-3-(3-methoxyphenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O4/c1-31-21-9-5-6-19(15-21)25-22(17-29(28-25)20-7-3-2-4-8-20)26(30)27-16-18-10-11-23-24(14-18)33-13-12-32-23/h2-11,14-15,17H,12-13,16H2,1H3,(H,27,30)