6-fluoranyl-1-(4-hydroxyphenyl)-3-phenylmethoxy-7-pyrrolidin-1-yl-quinazoline-2,4-dione

Systemtic Name: 6-fluoranyl-1-(4-hydroxyphenyl)-3-phenylmethoxy-7-pyrrolidin-1-yl-quinazoline-2,4-dione Openeye Name: 3-benzyloxy-6-fluoro-1-(4-hydroxyphenyl)-7-pyrrolidin-1-yl-quinazoline-2,4-dione CAS Name: 6-fluoro-1-(4-hydroxyphenyl)-3-phenylmethoxy-7-(1-pyrrolidinyl)quinazoline-2,4-dione IUPAC Name: 6-fluoro-1-(4-hydroxyphenyl)-3-phenylmethoxy-7-pyrrolidin-1-ylquinazoline-2,4-dione Traditional Name: 3-benzoxy-6-fluoro-1-(4-hydroxyphenyl)-7-pyrrolidino-quinazoline-2,4-quinone Formula: C25H22FN3O4 MolecularWeight: 447.458283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C3C(=C2)N(C(=O)N(C3=O)OCC4=CC=CC=C4)C5=CC=C(C=C5)O)F

Isomeric SMILES

C1CCN(C1)C2=C(C=C3C(=C2)N(C(=O)N(C3=O)OCC4=CC=CC=C4)C5=CC=C(C=C5)O)F

InChI

InChI=1S/C25H22FN3O4/c26-21-14-20-22(15-23(21)27-12-4-5-13-27)28(18-8-10-19(30)11-9-18)25(32)29(24(20)31)33-16-17-6-2-1-3-7-17/h1-3,6-11,14-15,30H,4-5,12-13,16H2