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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2-methyl-5-propyl-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-tert-butylphenyl)-2-methyl-5-propylpyrrole-3-carboxamide Traditional Name: 4-(4-tert-butylphenyl)-2-methyl-1-piperonyl-5-propyl-pyrrole-3-carboxamide Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)N)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCCC1=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/C27H32N2O3/c1-6-7-21-25(19-9-11-20(12-10-19)27(3,4)5)24(26(28)30)17(2)29(21)15-18-8-13-22-23(14-18)32-16-31-22/h8-14H,6-7,15-16H2,1-5H3,(H2,28,30)