1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone

Systemtic Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-chloranyl-3-methyl-phenoxy)ethanone Openeye Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-chloro-3-methyl-phenoxy)ethanone CAS Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethyl-3-pyrrolyl]-2-(4-chloro-3-methylphenoxy)ethanone IUPAC Name: 1-[1-(1,3-benzodioxol-5-ylmethyl)-2,5-dimethylpyrrol-3-yl]-2-(4-chloro-3-methylphenoxy)ethanone Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-1-(2,5-dimethyl-1-piperonyl-pyrrol-3-yl)ethanone Formula: C23H22ClNO4 MolecularWeight: 411.87808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)COC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=C(N1CC2=CC3=C(C=C2)OCO3)C)C(=O)COC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C23H22ClNO4/c1-14-8-18(5-6-20(14)24)27-12-21(26)19-9-15(2)25(16(19)3)11-17-4-7-22-23(10-17)29-13-28-22/h4-10H,11-13H2,1-3H3