4-methyl-2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]sulfonylamino]heptanoic acid

Systemtic Name: 4-methyl-2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]sulfonylamino]heptanoic acid Openeye Name: 4-methyl-2-[[4-(4-oxo-1-piperidyl)phenyl]sulfonylamino]heptanoic acid CAS Name: 4-methyl-2-[[4-(4-oxo-1-piperidinyl)phenyl]sulfonylamino]heptanoic acid IUPAC Name: 4-methyl-2-[[4-(4-oxopiperidin-1-yl)phenyl]sulfonylamino]heptanoic acid Traditional Name: 2-[[4-(4-ketopiperidino)phenyl]sulfonylamino]-4-methyl-enanthic acid Formula: C19H28N2O5S MolecularWeight: 396.50102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)N2CCC(=O)CC2

Isomeric SMILES

CCCC(C)CC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)N2CCC(=O)CC2

InChI

InChI=1S/C19H28N2O5S/c1-3-4-14(2)13-18(19(23)24)20-27(25,26)17-7-5-15(6-8-17)21-11-9-16(22)10-12-21/h5-8,14,18,20H,3-4,9-13H2,1-2H3,(H,23,24)