2-[4-[(2-chloranylquinolin-3-yl)methoxycarbonylamino]phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 2-[4-[(2-chloranylquinolin-3-yl)methoxycarbonylamino]phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-[4-[(2-chloro-3-quinolyl)methoxycarbonylamino]phenyl]-2-isopropoxy-propanoic acid CAS Name: 2-[4-[[(2-chloro-3-quinolinyl)methoxy-oxomethyl]amino]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 2-[4-[(2-chloroquinolin-3-yl)methoxycarbonylamino]phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-[4-[(2-chloro-3-quinolyl)methoxycarbonylamino]phenyl]-2-isopropoxy-propionic acid Formula: C23H23ClN2O5 MolecularWeight: 442.89212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(C)(C1=CC=C(C=C1)NC(=O)OCC2=CC3=CC=CC=C3N=C2Cl)C(=O)O

Isomeric SMILES

CC(C)OC(C)(C1=CC=C(C=C1)NC(=O)OCC2=CC3=CC=CC=C3N=C2Cl)C(=O)O

InChI

InChI=1S/C23H23ClN2O5/c1-14(2)31-23(3,21(27)28)17-8-10-18(11-9-17)25-22(29)30-13-16-12-15-6-4-5-7-19(15)26-20(16)24/h4-12,14H,13H2,1-3H3,(H,25,29)(H,27,28)