2-[4-[3-[bis[2-(6-chloranylpyridin-2-yl)-2-oxidanyl-ethyl]amino]butyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-[bis[2-(6-chloranylpyridin-2-yl)-2-oxidanyl-ethyl]amino]butyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3-[bis[2-(6-chloro-2-pyridyl)-2-hydroxy-ethyl]amino]butyl]phenoxy]acetic acid CAS Name: 2-[4-[3-[bis[2-(6-chloro-2-pyridinyl)-2-hydroxyethyl]amino]butyl]phenoxy]acetic acid IUPAC Name: 2-[4-[3-[bis[2-(6-chloropyridin-2-yl)-2-hydroxyethyl]amino]butyl]phenoxy]acetic acid Traditional Name: 2-[4-[3-[bis[2-(6-chloro-2-pyridyl)-2-hydroxy-ethyl]amino]butyl]phenoxy]acetic acid Formula: C26H29Cl2N3O5 MolecularWeight: 534.43156

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OCC(=O)O)N(CC(C2=NC(=CC=C2)Cl)O)CC(C3=NC(=CC=C3)Cl)O

Isomeric SMILES

CC(CCC1=CC=C(C=C1)OCC(=O)O)N(CC(C2=NC(=CC=C2)Cl)O)CC(C3=NC(=CC=C3)Cl)O

InChI

InChI=1S/C26H29Cl2N3O5/c1-17(8-9-18-10-12-19(13-11-18)36-16-26(34)35)31(14-22(32)20-4-2-6-24(27)29-20)15-23(33)21-5-3-7-25(28)30-21/h2-7,10-13,17,22-23,32-33H,8-9,14-16H2,1H3,(H,34,35)