3-[[2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1,5-benzoxazepin-4-yl]amino]-2-methyl-quinazolin-4-one

Systemtic Name: 3-[[2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1,5-benzoxazepin-4-yl]amino]-2-methyl-quinazolin-4-one Openeye Name: 3-[[2-(4-hydroxy-3-methoxy-phenyl)-2,3-dihydro-1,5-benzoxazepin-4-yl]amino]-2-methyl-quinazolin-4-one CAS Name: 3-[[2-(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1,5-benzoxazepin-4-yl]amino]-2-methyl-4-quinazolinone IUPAC Name: 3-[[2-(4-hydroxy-3-methoxyphenyl)-2,3-dihydro-1,5-benzoxazepin-4-yl]amino]-2-methylquinazolin-4-one Traditional Name: 3-[[2-(4-hydroxy-3-methoxy-phenyl)-2,3-dihydro-1,5-benzoxazepin-4-yl]amino]-2-methyl-quinazolin-4-one Formula: C25H22N4O4 MolecularWeight: 442.46658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1NC3=NC4=CC=CC=C4OC(C3)C5=CC(=C(C=C5)O)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1NC3=NC4=CC=CC=C4OC(C3)C5=CC(=C(C=C5)O)OC

InChI

InChI=1S/C25H22N4O4/c1-15-26-18-8-4-3-7-17(18)25(31)29(15)28-24-14-22(16-11-12-20(30)23(13-16)32-2)33-21-10-6-5-9-19(21)27-24/h3-13,22,30H,14H2,1-2H3,(H,27,28)