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

Systemtic Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-chloranyl-2-cyclohexyl-phenoxy)ethanone Openeye Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-chloro-2-cyclohexyl-phenoxy)ethanone CAS Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-(4-chloro-2-cyclohexylphenoxy)ethanone IUPAC Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-2-(4-chloro-2-cyclohexylphenoxy)ethanone Traditional Name: 1-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-2-(4-chloro-2-cyclohexyl-phenoxy)ethanone Formula: C27H28ClNO4 MolecularWeight: 465.96852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)COC4=C(C=C(C=C4)Cl)C5CCCCC5

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C(=O)COC4=C(C=C(C=C4)Cl)C5CCCCC5

InChI

InChI=1S/C27H28ClNO4/c1-17-12-22(18(2)29(17)21-9-11-26-27(14-21)33-16-32-26)24(30)15-31-25-10-8-20(28)13-23(25)19-6-4-3-5-7-19/h8-14,19H,3-7,15-16H2,1-2H3