2-[4-[3-azanyl-4-(6-chloranylpyridin-2-yl)-2-methyl-4-oxidanyl-butyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[3-azanyl-4-(6-chloranylpyridin-2-yl)-2-methyl-4-oxidanyl-butyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[3-amino-4-(6-chloro-2-pyridyl)-4-hydroxy-2-methyl-butyl]phenoxy]acetic acid CAS Name: 2-[4-[3-amino-4-(6-chloro-2-pyridinyl)-4-hydroxy-2-methylbutyl]phenoxy]acetic acid IUPAC Name: 2-[4-[3-amino-4-(6-chloropyridin-2-yl)-4-hydroxy-2-methylbutyl]phenoxy]acetic acid Traditional Name: 2-[4-[3-amino-4-(6-chloro-2-pyridyl)-4-hydroxy-2-methyl-butyl]phenoxy]acetic acid Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)OCC(=O)O)C(C(C2=NC(=CC=C2)Cl)O)N

Isomeric SMILES

CC(CC1=CC=C(C=C1)OCC(=O)O)C(C(C2=NC(=CC=C2)Cl)O)N

InChI

InChI=1S/C18H21ClN2O4/c1-11(17(20)18(24)14-3-2-4-15(19)21-14)9-12-5-7-13(8-6-12)25-10-16(22)23/h2-8,11,17-18,24H,9-10,20H2,1H3,(H,22,23)