[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 3-methylbut-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl] 3-methylbut-2-enoate Openeye Name: [2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl] 3-methylbut-2-enoate CAS Name: 3-methyl-2-butenoic acid [2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl] 3-methylbut-2-enoate Traditional Name: 3-methylbut-2-enoic acid [2-keto-2-(3-piperidinosulfonylanilino)ethyl] ester Formula: C18H24N2O5S MolecularWeight: 380.45856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)C

Isomeric SMILES

CC(=CC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)C

InChI

InChI=1S/C18H24N2O5S/c1-14(2)11-18(22)25-13-17(21)19-15-7-6-8-16(12-15)26(23,24)20-9-4-3-5-10-20/h6-8,11-12H,3-5,9-10,13H2,1-2H3,(H,19,21)