ethyl 1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-3,5-dimethyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 3,5-dimethyl-1-[4-(piperonylcarbamoyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1C)C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C23H23N3O5/c1-4-29-23(28)21-14(2)25-26(15(21)3)18-8-6-17(7-9-18)22(27)24-12-16-5-10-19-20(11-16)31-13-30-19/h5-11H,4,12-13H2,1-3H3,(H,24,27)