[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1H-pyrazol-5-yl)methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1H-pyrazol-5-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1H-pyrazol-5-yl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-(1H-pyrazol-5-yl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-(1H-pyrazol-5-yl)methanone Traditional Name: (4-piperonylpiperazino)-(1H-pyrazol-5-yl)methanone Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NN4

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC=NN4

InChI

InChI=1S/C16H18N4O3/c21-16(13-3-4-17-18-13)20-7-5-19(6-8-20)10-12-1-2-14-15(9-12)23-11-22-14/h1-4,9H,5-8,10-11H2,(H,17,18)