methyl 3-[1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: methyl 3-[1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: methyl 3-[1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-[4-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]phenyl]-3,5-dimethyl-4-pyrazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[1-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[3,5-dimethyl-1-[4-(piperonylcarbamoyl)phenyl]pyrazol-4-yl]propionic acid methyl ester Formula: C24H25N3O5 MolecularWeight: 435.4724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C)CCC(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)C)CCC(=O)OC

InChI

InChI=1S/C24H25N3O5/c1-15-20(9-11-23(28)30-3)16(2)27(26-15)19-7-5-18(6-8-19)24(29)25-13-17-4-10-21-22(12-17)32-14-31-21/h4-8,10,12H,9,11,13-14H2,1-3H3,(H,25,29)