4-[4-[[4-(propan-2-ylsulfonylamino)cyclohexyl]carbonylamino]phenyl]butanoic acid

Systemtic Name: 4-[4-[[4-(propan-2-ylsulfonylamino)cyclohexyl]carbonylamino]phenyl]butanoic acid Openeye Name: 4-[4-[[4-(isopropylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butanoic acid CAS Name: 4-[4-[[oxo-[4-(propan-2-ylsulfonylamino)cyclohexyl]methyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[[4-(propan-2-ylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butanoic acid Traditional Name: 4-[4-[[4-(isopropylsulfonylamino)cyclohexanecarbonyl]amino]phenyl]butyric acid Formula: C20H30N2O5S MolecularWeight: 410.5276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

CC(C)S(=O)(=O)NC1CCC(CC1)C(=O)NC2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C20H30N2O5S/c1-14(2)28(26,27)22-18-12-8-16(9-13-18)20(25)21-17-10-6-15(7-11-17)4-3-5-19(23)24/h6-7,10-11,14,16,18,22H,3-5,8-9,12-13H2,1-2H3,(H,21,25)(H,23,24)