1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-quinolin-2-yl-pyrrole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-quinolin-2-yl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-(2-quinolyl)pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-(2-quinolinyl)-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-quinolin-2-ylpyrrole-3-carboxamide Traditional Name: 5-ethyl-2-methyl-1-piperonyl-4-(2-quinolyl)pyrrole-3-carboxamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H23N3O3/c1-3-20-24(19-10-9-17-6-4-5-7-18(17)27-19)23(25(26)29)15(2)28(20)13-16-8-11-21-22(12-16)31-14-30-21/h4-12H,3,13-14H2,1-2H3,(H2,26,29)