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

Systemtic Name: N-butyl-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-butyl-1,3-benzodioxole-5-carboxamide CAS Name: N-butyl-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-butyl-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-N-butyl-piperonylamide Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O3/c1-2-3-13-26(24(27)20-11-12-22-23(15-20)29-18-28-22)17-21-10-7-14-25(21)16-19-8-5-4-6-9-19/h4-12,14-15H,2-3,13,16-18H2,1H3