ethyl 1-[4-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(1,3-benzodioxol-5-ylcarbonylamino)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazo]-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(1,3-benzodioxole-5-carbonylamino)carbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[(piperonyloylamino)carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C22H20N4O6 MolecularWeight: 436.4174

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NNC(=O)C3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H20N4O6/c1-3-30-22(29)17-11-23-26(13(17)2)16-7-4-14(5-8-16)20(27)24-25-21(28)15-6-9-18-19(10-15)32-12-31-18/h4-11H,3,12H2,1-2H3,(H,24,27)(H,25,28)