5-[4-[4-(2-methylpropyl)phenyl]sulfonylpiperazin-1-yl]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[4-[4-(2-methylpropyl)phenyl]sulfonylpiperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[4-(4-isobutylphenyl)sulfonylpiperazin-1-yl]-5-oxo-pentanoic acid CAS Name: 5-[4-[4-(2-methylpropyl)phenyl]sulfonyl-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: 5-[4-[4-(2-methylpropyl)phenyl]sulfonylpiperazin-1-yl]-5-oxopentanoic acid Traditional Name: 5-[4-(4-isobutylphenyl)sulfonylpiperazino]-5-keto-valeric acid Formula: C19H28N2O5S MolecularWeight: 396.50102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC(=O)O

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC(=O)O

InChI

InChI=1S/C19H28N2O5S/c1-15(2)14-16-6-8-17(9-7-16)27(25,26)21-12-10-20(11-13-21)18(22)4-3-5-19(23)24/h6-9,15H,3-5,10-14H2,1-2H3,(H,23,24)