2-[1-(4-butoxyphenyl)ethyl]-3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-pentanoic acid

Systemtic Name: 2-[1-(4-butoxyphenyl)ethyl]-3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-pentanoic acid Openeye Name: 2-[1-(4-butoxyphenyl)ethyl]-3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-pentanoic acid CAS Name: 2-[1-(4-butoxyphenyl)ethyl]-3-[(4-chlorophenyl)sulfonylamino]-2-phenylpentanoic acid IUPAC Name: 2-[1-(4-butoxyphenyl)ethyl]-3-[(4-chlorophenyl)sulfonylamino]-2-phenylpentanoic acid Traditional Name: 2-[1-(4-butoxyphenyl)ethyl]-3-[(4-chlorophenyl)sulfonylamino]-2-phenyl-valeric acid Formula: C29H34ClNO5S MolecularWeight: 544.10196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C)C(C2=CC=CC=C2)(C(CC)NS(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(C)C(C2=CC=CC=C2)(C(CC)NS(=O)(=O)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C29H34ClNO5S/c1-4-6-20-36-25-16-12-22(13-17-25)21(3)29(28(32)33,23-10-8-7-9-11-23)27(5-2)31-37(34,35)26-18-14-24(30)15-19-26/h7-19,21,27,31H,4-6,20H2,1-3H3,(H,32,33)