[(Z)-3-methyl-4-pyrrolidin-1-ylsulfonyl-but-2-enyl] benzoate

Systemtic Name: [(Z)-3-methyl-4-pyrrolidin-1-ylsulfonyl-but-2-enyl] benzoate Openeye Name: [(Z)-3-methyl-4-pyrrolidin-1-ylsulfonyl-but-2-enyl] benzoate CAS Name: benzoic acid [(Z)-3-methyl-4-(1-pyrrolidinylsulfonyl)but-2-enyl] ester IUPAC Name: [(Z)-3-methyl-4-pyrrolidin-1-ylsulfonylbut-2-enyl] benzoate Traditional Name: benzoic acid [(Z)-3-methyl-4-pyrrolidinosulfonyl-but-2-enyl] ester Formula: C16H21NO4S MolecularWeight: 323.40724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC(=O)C1=CC=CC=C1)CS(=O)(=O)N2CCCC2

Isomeric SMILES

C/C(=C/COC(=O)C1=CC=CC=C1)/CS(=O)(=O)N2CCCC2

InChI

InChI=1S/C16H21NO4S/c1-14(13-22(19,20)17-10-5-6-11-17)9-12-21-16(18)15-7-3-2-4-8-15/h2-4,7-9H,5-6,10-13H2,1H3/b14-9-