4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-fluorophenyl)quinazoline

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-fluorophenyl)quinazoline Openeye Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-fluorophenyl)quinazoline CAS Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-(2-fluorophenyl)quinazoline IUPAC Name: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2-fluorophenyl)quinazoline Traditional Name: 2-(2-fluorophenyl)-4-(4-piperonylpiperazino)quinazoline Formula: C26H23FN4O2 MolecularWeight: 442.484823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC(=NC5=CC=CC=C54)C6=CC=CC=C6F

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C4=NC(=NC5=CC=CC=C54)C6=CC=CC=C6F

InChI

InChI=1S/C26H23FN4O2/c27-21-7-3-1-5-19(21)25-28-22-8-4-2-6-20(22)26(29-25)31-13-11-30(12-14-31)16-18-9-10-23-24(15-18)33-17-32-23/h1-10,15H,11-14,16-17H2