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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-phenyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-phenyl-pyrazole-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-phenyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-phenylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-phenyl-pyrazole-4-carboxamide Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CN(N=C3C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H25N3O3/c1-29(17-21-12-13-24-25(16-21)33-15-14-32-24)27(31)23-19-30(18-20-8-4-2-5-9-20)28-26(23)22-10-6-3-7-11-22/h2-13,16,19H,14-15,17-18H2,1H3