1-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-5-methylpyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide Formula: C22H22BrN3O3 MolecularWeight: 456.33238

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C22H22BrN3O3/c1-3-25(14-16-4-9-20-21(12-16)29-11-10-28-20)22(27)19-13-24-26(15(19)2)18-7-5-17(23)6-8-18/h4-9,12-13H,3,10-11,14H2,1-2H3