methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-phenyl-butyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-phenyl-butyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-phenyl-butyl]phenyl]butanoate CAS Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-phenylbutyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-phenylbutyl]phenyl]butanoate Traditional Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]-3-phenyl-butyl]phenyl]butyric acid methyl ester Formula: C27H30ClNO4S MolecularWeight: 500.0494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC(CC(C1=CC=C(C=C1)CCCC(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C27H30ClNO4S/c1-20(22-8-4-3-5-9-22)19-26(29-34(31,32)25-17-15-24(28)16-18-25)23-13-11-21(12-14-23)7-6-10-27(30)33-2/h3-5,8-9,11-18,20,26,29H,6-7,10,19H2,1-2H3