N5-(1,3-benzodioxol-5-ylmethyl)-N5-ethyl-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-(1,3-benzodioxol-5-ylmethyl)-N5-ethyl-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-(1,3-benzodioxol-5-ylmethyl)-N5-ethyl-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-(1,3-benzodioxol-5-ylmethyl)-N5-ethyl-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-(1,3-benzodioxol-5-ylmethyl)-5-N-ethyl-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-ethyl-1-phenyl-N-piperonyl-2-pyrazoline-3,5-dicarboxamide Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4/c1-2-24(12-14-8-9-18-19(10-14)29-13-28-18)21(27)16-11-17(20(22)26)25(23-16)15-6-4-3-5-7-15/h3-10,17H,2,11-13H2,1H3,(H2,22,26)