N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrrole-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrrole-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3,5-dimethyl-1-(o-tolylmethyl)pyrrole-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3,5-dimethyl-1-[(2-methylphenyl)methyl]-2-pyrrolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-ethyl-3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrrole-2-carboxamide Traditional Name: 4-ethyl-3,5-dimethyl-1-(2-methylbenzyl)-N-piperonyl-pyrrole-2-carboxamide Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=C1C)C(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4C)C

Isomeric SMILES

CCC1=C(N(C(=C1C)C(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4C)C

InChI

InChI=1S/C25H28N2O3/c1-5-21-17(3)24(27(18(21)4)14-20-9-7-6-8-16(20)2)25(28)26-13-19-10-11-22-23(12-19)30-15-29-22/h6-12H,5,13-15H2,1-4H3,(H,26,28)