(2-phenyl-1,3-dioxan-5-yl) 2-[(7-chloranylquinolin-4-yl)amino]benzoate

Systemtic Name: (2-phenyl-1,3-dioxan-5-yl) 2-[(7-chloranylquinolin-4-yl)amino]benzoate Openeye Name: (2-phenyl-1,3-dioxan-5-yl) 2-[(7-chloro-4-quinolyl)amino]benzoate CAS Name: 2-[(7-chloro-4-quinolinyl)amino]benzoic acid (2-phenyl-1,3-dioxan-5-yl) ester IUPAC Name: (2-phenyl-1,3-dioxan-5-yl) 2-[(7-chloroquinolin-4-yl)amino]benzoate Traditional Name: 2-[(7-chloro-4-quinolyl)amino]benzoic acid (2-phenyl-1,3-dioxan-5-yl) ester Formula: C26H21ClN2O4 MolecularWeight: 460.90894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(COC(O1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1C(COC(O1)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C26H21ClN2O4/c27-18-10-11-20-23(12-13-28-24(20)14-18)29-22-9-5-4-8-21(22)25(30)33-19-15-31-26(32-16-19)17-6-2-1-3-7-17/h1-14,19,26H,15-16H2,(H,28,29)