N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide CAS Name: N-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide Traditional Name: N-amyl-N-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-piperonylamide Formula: C25H27FN2O3 MolecularWeight: 422.491883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H27FN2O3/c1-2-3-4-12-28(25(29)20-10-11-23-24(15-20)31-18-30-23)17-22-9-6-13-27(22)16-19-7-5-8-21(26)14-19/h5-11,13-15H,2-4,12,16-18H2,1H3