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

Systemtic Name: N-pentyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide CAS Name: N-pentyl-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-pentyl-1,3-benzodioxole-5-carboxamide Traditional Name: N-amyl-N-[(1-benzylpyrrol-2-yl)methyl]-piperonylamide Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O3/c1-2-3-7-14-27(25(28)21-12-13-23-24(16-21)30-19-29-23)18-22-11-8-15-26(22)17-20-9-5-4-6-10-20/h4-6,8-13,15-16H,2-3,7,14,17-19H2,1H3