2-[3-chloranyl-4-[(4-phenoxy-2-propyl-phenoxy)-propyl-amino]phenyl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-[(4-phenoxy-2-propyl-phenoxy)-propyl-amino]phenyl]ethanoic acid Openeye Name: 2-[3-chloro-4-[(4-phenoxy-2-propyl-phenoxy)-propyl-amino]phenyl]acetic acid CAS Name: 2-[3-chloro-4-[(4-phenoxy-2-propylphenoxy)-propylamino]phenyl]acetic acid IUPAC Name: 2-[3-chloro-4-[(4-phenoxy-2-propylphenoxy)-propylamino]phenyl]acetic acid Traditional Name: 2-[3-chloro-4-[(4-phenoxy-2-propyl-phenoxy)-propyl-amino]phenyl]acetic acid Formula: C26H28ClNO4 MolecularWeight: 453.95782

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)ON(CCC)C3=C(C=C(C=C3)CC(=O)O)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)OC2=CC=CC=C2)ON(CCC)C3=C(C=C(C=C3)CC(=O)O)Cl

InChI

InChI=1S/C26H28ClNO4/c1-3-8-20-18-22(31-21-9-6-5-7-10-21)12-14-25(20)32-28(15-4-2)24-13-11-19(16-23(24)27)17-26(29)30/h5-7,9-14,16,18H,3-4,8,15,17H2,1-2H3,(H,29,30)