1-(4-fluorophenyl)-4-(9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)butane-1,4-dione

Systemtic Name: 1-(4-fluorophenyl)-4-(9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)butane-1,4-dione Openeye Name: 1-(4-fluorophenyl)-4-[9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]butane-1,4-dione CAS Name: 1-(4-fluorophenyl)-4-[9-methoxy-7-(3-quinolinyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]butane-1,4-dione IUPAC Name: 1-(4-fluorophenyl)-4-(9-methoxy-7-quinolin-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)butane-1,4-dione Traditional Name: 1-(4-fluorophenyl)-4-[9-methoxy-7-(3-quinolyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]butane-1,4-dione Formula: C29H25FN2O4 MolecularWeight: 484.518203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCCN(C2)C(=O)CCC(=O)C3=CC=C(C=C3)F)C4=CC5=CC=CC=C5N=C4

Isomeric SMILES

COC1=CC(=CC2=C1OCCN(C2)C(=O)CCC(=O)C3=CC=C(C=C3)F)C4=CC5=CC=CC=C5N=C4

InChI

InChI=1S/C29H25FN2O4/c1-35-27-16-21(22-14-20-4-2-3-5-25(20)31-17-22)15-23-18-32(12-13-36-29(23)27)28(34)11-10-26(33)19-6-8-24(30)9-7-19/h2-9,14-17H,10-13,18H2,1H3