5-chloranyl-2-[2-[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-yl-amino]ethoxy]benzoic acid

Systemtic Name: 5-chloranyl-2-[2-[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-yl-amino]ethoxy]benzoic acid Openeye Name: 2-[2-[tert-butoxycarbonyl(2-pyridyl)amino]ethoxy]-5-chloro-benzoic acid CAS Name: 5-chloro-2-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(2-pyridinyl)amino]ethoxy]benzoic acid IUPAC Name: 5-chloro-2-[2-[(2-methylpropan-2-yl)oxycarbonyl-pyridin-2-ylamino]ethoxy]benzoic acid Traditional Name: 2-[2-[tert-butoxycarbonyl(2-pyridyl)amino]ethoxy]-5-chloro-benzoic acid Formula: C19H21ClN2O5 MolecularWeight: 392.83344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCOC1=C(C=C(C=C1)Cl)C(=O)O)C2=CC=CC=N2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCOC1=C(C=C(C=C1)Cl)C(=O)O)C2=CC=CC=N2

InChI

InChI=1S/C19H21ClN2O5/c1-19(2,3)27-18(25)22(16-6-4-5-9-21-16)10-11-26-15-8-7-13(20)12-14(15)17(23)24/h4-9,12H,10-11H2,1-3H3,(H,23,24)