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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-(3-phenoxyphenyl)-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-2-methyl-4-(3-phenoxyphenyl)pyrrole-3-carboxamide Traditional Name: 5-ethyl-2-methyl-4-(3-phenoxyphenyl)-1-piperonyl-pyrrole-3-carboxamide Formula: C28H26N2O4 MolecularWeight: 454.51704

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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=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C28H26N2O4/c1-3-23-27(20-8-7-11-22(15-20)34-21-9-5-4-6-10-21)26(28(29)31)18(2)30(23)16-19-12-13-24-25(14-19)33-17-32-24/h4-15H,3,16-17H2,1-2H3,(H2,29,31)