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

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[1-(3-chloranyl-4-fluoranyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[1-(3-chloro-4-fluorophenyl)-2,5-dimethyl-3-pyrrolyl]ethanone IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-1-[1-(3-chloro-4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]ethanone Traditional Name: 1-[1-(3-chloro-4-fluoro-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-[methyl(piperonyl)amino]ethanone Formula: C23H22ClFN2O3 MolecularWeight: 428.883783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C(=O)CN(C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)F)Cl)C)C(=O)CN(C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H22ClFN2O3/c1-14-8-18(15(2)27(14)17-5-6-20(25)19(24)10-17)21(28)12-26(3)11-16-4-7-22-23(9-16)30-13-29-22/h4-10H,11-13H2,1-3H3