[2-[(3-butylquinolin-4-yl)oxymethyl]-6-phenyl-phenyl] hydrogen carbonate

Systemtic Name: [2-[(3-butylquinolin-4-yl)oxymethyl]-6-phenyl-phenyl] hydrogen carbonate Openeye Name: [2-[(3-butyl-4-quinolyl)oxymethyl]-6-phenyl-phenyl] hydrogen carbonate CAS Name: carbonic acid [2-[(3-butyl-4-quinolinyl)oxymethyl]-6-phenylphenyl] ester IUPAC Name: [2-[(3-butylquinolin-4-yl)oxymethyl]-6-phenylphenyl] hydrogen carbonate Traditional Name: carbonic acid [2-[(3-butyl-4-quinolyl)oxymethyl]-6-phenyl-phenyl] ester Formula: C27H25NO4 MolecularWeight: 427.4917

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N=C1)OCC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N=C1)OCC3=CC=CC(=C3OC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C27H25NO4/c1-2-3-10-20-17-28-24-16-8-7-14-23(24)25(20)31-18-21-13-9-15-22(26(21)32-27(29)30)19-11-5-4-6-12-19/h4-9,11-17H,2-3,10,18H2,1H3,(H,29,30)