5-(1,3-benzodioxol-5-yloxymethyl)-N-cyclohexyl-N-prop-2-ynyl-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-cyclohexyl-N-prop-2-ynyl-1H-pyrazole-3-carboxamide Openeye Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-cyclohexyl-N-prop-2-ynyl-1H-pyrazole-3-carboxamide CAS Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-cyclohexyl-N-prop-2-ynyl-1H-pyrazole-3-carboxamide IUPAC Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-cyclohexyl-N-prop-2-ynyl-1H-pyrazole-3-carboxamide Traditional Name: 5-(1,3-benzodioxol-5-yloxymethyl)-N-cyclohexyl-N-propargyl-1H-pyrazole-3-carboxamide Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C1CCCCC1)C(=O)C2=NNC(=C2)COC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C#CCN(C1CCCCC1)C(=O)C2=NNC(=C2)COC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23N3O4/c1-2-10-24(16-6-4-3-5-7-16)21(25)18-11-15(22-23-18)13-26-17-8-9-19-20(12-17)28-14-27-19/h1,8-9,11-12,16H,3-7,10,13-14H2,(H,22,23)