methyl 4-[4-[5-(propan-2-ylsulfonylamino)pentanoylamino]phenyl]butanoate

Systemtic Name: methyl 4-[4-[5-(propan-2-ylsulfonylamino)pentanoylamino]phenyl]butanoate Openeye Name: methyl 4-[4-[5-(isopropylsulfonylamino)pentanoylamino]phenyl]butanoate CAS Name: 4-[4-[[1-oxo-5-(propan-2-ylsulfonylamino)pentyl]amino]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[5-(propan-2-ylsulfonylamino)pentanoylamino]phenyl]butanoate Traditional Name: 4-[4-[5-(isopropylsulfonylamino)pentanoylamino]phenyl]butyric acid methyl ester Formula: C19H30N2O5S MolecularWeight: 398.5169

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)NCCCCC(=O)NC1=CC=C(C=C1)CCCC(=O)OC

Isomeric SMILES

CC(C)S(=O)(=O)NCCCCC(=O)NC1=CC=C(C=C1)CCCC(=O)OC

InChI

InChI=1S/C19H30N2O5S/c1-15(2)27(24,25)20-14-5-4-8-18(22)21-17-12-10-16(11-13-17)7-6-9-19(23)26-3/h10-13,15,20H,4-9,14H2,1-3H3,(H,21,22)