N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(3-methoxyphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-benzyl-3-(3-methoxyphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-3-(3-methoxyphenyl)-N-piperonyl-pyrazole-4-carboxamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NCC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN(C=C2C(=O)NCC3=CC4=C(C=C3)OCO4)CC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O4/c1-31-21-9-5-8-20(13-21)25-22(16-29(28-25)15-18-6-3-2-4-7-18)26(30)27-14-19-10-11-23-24(12-19)33-17-32-23/h2-13,16H,14-15,17H2,1H3,(H,27,30)