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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-4-(3-hydroxyphenyl)-2-methyl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-4-(3-hydroxyphenyl)-2-methyl-pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-4-(3-hydroxyphenyl)-2-methyl-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-5-ethyl-4-(3-hydroxyphenyl)-2-methylpyrrole-3-carboxamide Traditional Name: 5-ethyl-4-(3-hydroxyphenyl)-2-methyl-1-piperonyl-pyrrole-3-carboxamide Formula: C22H22N2O4 MolecularWeight: 378.42108

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O4/c1-3-17-21(15-5-4-6-16(25)10-15)20(22(23)26)13(2)24(17)11-14-7-8-18-19(9-14)28-12-27-18/h4-10,25H,3,11-12H2,1-2H3,(H2,23,26)