[2-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-5-methyl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-5-methyl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]-5-methyl-pyrazol-3-yl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]-5-methylpyrazol-3-yl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [5-methyl-2-[4-(piperonyloylamino)phenyl]pyrazol-3-yl] ester Formula: C26H19N3O7 MolecularWeight: 485.44496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)OC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)NC(=O)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=NN(C(=C1)OC(=O)C2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)NC(=O)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H19N3O7/c1-15-10-24(36-26(31)17-3-9-21-23(12-17)35-14-33-21)29(28-15)19-6-4-18(5-7-19)27-25(30)16-2-8-20-22(11-16)34-13-32-20/h2-12H,13-14H2,1H3,(H,27,30)