methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]octyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]octyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]octyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]octyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]octyl]phenyl]butanoate Traditional Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]octyl]phenyl]butyric acid methyl ester Formula: C25H34ClNO4S MolecularWeight: 480.05976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C25H34ClNO4S/c1-3-4-5-6-7-10-24(27-32(29,30)23-18-16-22(26)17-19-23)21-14-12-20(13-15-21)9-8-11-25(28)31-2/h12-19,24,27H,3-11H2,1-2H3