4-[2-(1,3-benzodioxol-5-yl)-2-methyl-pyrrolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[2-(1,3-benzodioxol-5-yl)-2-methyl-pyrrolidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[2-(1,3-benzodioxol-5-yl)-2-methyl-pyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[2-(1,3-benzodioxol-5-yl)-2-methyl-1-pyrrolidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[2-(1,3-benzodioxol-5-yl)-2-methylpyrrolidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[2-(1,3-benzodioxol-5-yl)-2-methyl-pyrrolidino]-2-(trifluoromethyl)benzonitrile Formula: C20H17F3N2O2 MolecularWeight: 374.35639

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1(CCCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H17F3N2O2/c1-19(14-4-6-17-18(9-14)27-12-26-17)7-2-8-25(19)15-5-3-13(11-24)16(10-15)20(21,22)23/h3-6,9-10H,2,7-8,12H2,1H3