ethyl 2-[4-methylidene-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-methylidene-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-yl]ethanoate Openeye Name: ethyl 2-[4-methylene-1-(p-tolylsulfonyl)pyrrolidin-3-yl]acetate CAS Name: 2-[4-methylene-1-(4-methylphenyl)sulfonyl-3-pyrrolidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-methylidene-1-(4-methylphenyl)sulfonylpyrrolidin-3-yl]acetate Traditional Name: 2-(4-methylene-1-tosyl-pyrrolidin-3-yl)acetic acid ethyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(CC1=C)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)CC1CN(CC1=C)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H21NO4S/c1-4-21-16(18)9-14-11-17(10-13(14)3)22(19,20)15-7-5-12(2)6-8-15/h5-8,14H,3-4,9-11H2,1-2H3