2-fluoranyl-N,N-dimethyl-4-pyrrolidin-2-yl-aniline; 4-methylbenzenesulfonyl chloride

Systemtic Name: 2-fluoranyl-N,N-dimethyl-4-pyrrolidin-2-yl-aniline; 4-methylbenzenesulfonyl chloride Openeye Name: 2-fluoro-N,N-dimethyl-4-pyrrolidin-2-yl-aniline; 4-methylbenzenesulfonyl chloride CAS Name: 2-fluoro-N,N-dimethyl-4-(2-pyrrolidinyl)aniline; 4-methylbenzenesulfonyl chloride IUPAC Name: 2-fluoro-N,N-dimethyl-4-pyrrolidin-2-ylaniline; 4-methylbenzenesulfonyl chloride Traditional Name: (2-fluoro-4-pyrrolidin-2-yl-phenyl)-dimethyl-amine; 4-methylbenzenesulfonyl chloride Formula: C19H24ClFN2O2S MolecularWeight: 398.922463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)Cl.CN(C)C1=C(C=C(C=C1)C2CCCN2)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)Cl.CN(C)C1=C(C=C(C=C1)C2CCCN2)F

InChI

InChI=1S/C12H17FN2.C7H7ClO2S/c1-15(2)12-6-5-9(8-10(12)13)11-4-3-7-14-11;1-6-2-4-7(5-3-6)11(8,9)10/h5-6,8,11,14H,3-4,7H2,1-2H3;2-5H,1H3