1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2,5-dimethyl-pyrrole-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2,5-dimethyl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2,5-dimethyl-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2,5-dimethylpyrrole-3-carboxamide Traditional Name: 4-(4-tert-butylphenyl)-2,5-dimethyl-1-piperonyl-pyrrole-3-carboxamide Formula: C25H28N2O3 MolecularWeight: 404.50142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC=C(C=C4)C(C)(C)C

InChI

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