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

Systemtic Name: 3-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1H-pyrazole-5-carboxamide CAS Name: 3-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-bromophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-1H-pyrazole-5-carboxamide Formula: C20H18BrN3O3 MolecularWeight: 428.27922

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=NN3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H18BrN3O3/c1-24(12-13-2-7-18-19(10-13)27-9-8-26-18)20(25)17-11-16(22-23-17)14-3-5-15(21)6-4-14/h2-7,10-11H,8-9,12H2,1H3,(H,22,23)