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

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxyphenyl)-2,5-dimethyl-pyrrole-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxyphenyl)-2,5-dimethyl-pyrrole-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxyphenyl)-2,5-dimethyl-3-pyrrolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxyphenyl)-2,5-dimethylpyrrole-3-carboxamide Traditional Name: 4-(3-hydroxyphenyl)-2,5-dimethyl-1-piperonyl-pyrrole-3-carboxamide Formula: C21H20N2O4 MolecularWeight: 364.3945

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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(=CC=C4)O

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O4/c1-12-19(15-4-3-5-16(24)9-15)20(21(22)25)13(2)23(12)10-14-6-7-17-18(8-14)27-11-26-17/h3-9,24H,10-11H2,1-2H3,(H2,22,25)