2-[4-(deuteriomethylidene)-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-yl]-1-phenyl-ethanone

Systemtic Name: 2-[4-(deuteriomethylidene)-1-(4-methylphenyl)sulfonyl-pyrrolidin-3-yl]-1-phenyl-ethanone Openeye Name: 2-[4-(deuteriomethylene)-1-(p-tolylsulfonyl)pyrrolidin-3-yl]-1-phenyl-ethanone CAS Name: 2-[4-(deuteriomethylidene)-1-(4-methylphenyl)sulfonyl-3-pyrrolidinyl]-1-phenylethanone IUPAC Name: 2-[4-(deuteriomethylidene)-1-(4-methylphenyl)sulfonylpyrrolidin-3-yl]-1-phenylethanone Traditional Name: 2-[4-(deuteriomethylene)-1-tosyl-pyrrolidin-3-yl]-1-phenyl-ethanone Formula: C20H21NO3S MolecularWeight: 356.456802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(=C)C2)CC(=O)C3=CC=CC=C3

Isomeric SMILES

[2H]C=C1CN(CC1CC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H21NO3S/c1-15-8-10-19(11-9-15)25(23,24)21-13-16(2)18(14-21)12-20(22)17-6-4-3-5-7-17/h3-11,18H,2,12-14H2,1H3/i2D