N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)-N-ethyl-5-methyl-pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)-N-ethyl-5-methyl-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-bromophenyl)-N-ethyl-5-methylpyrazole-4-carboxamide Traditional Name: 1-(4-bromophenyl)-N-ethyl-5-methyl-N-piperonyl-pyrazole-4-carboxamide Formula: C21H20BrN3O3 MolecularWeight: 442.3058

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C21H20BrN3O3/c1-3-24(12-15-4-9-19-20(10-15)28-13-27-19)21(26)18-11-23-25(14(18)2)17-7-5-16(22)6-8-17/h4-11H,3,12-13H2,1-2H3