9-butyl-2-(3-chlorophenyl)-7,8-dihydropyrimido[4,5-e][1,4]oxazepin-5-one

Systemtic Name: 9-butyl-2-(3-chlorophenyl)-7,8-dihydropyrimido[4,5-e][1,4]oxazepin-5-one Openeye Name: 9-butyl-2-(3-chlorophenyl)-7,8-dihydropyrimido[4,5-e][1,4]oxazepin-5-one CAS Name: 9-butyl-2-(3-chlorophenyl)-7,8-dihydropyrimido[4,5-e][1,4]oxazepin-5-one IUPAC Name: 9-butyl-2-(3-chlorophenyl)-7,8-dihydropyrimido[4,5-e][1,4]oxazepin-5-one Traditional Name: 9-butyl-2-(3-chlorophenyl)-7,8-dihydropyrimido[4,5-e][1,4]oxazepin-5-one Formula: C17H18ClN3O2 MolecularWeight: 331.79672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCOC(=O)C2=CN=C(N=C21)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCCN1CCOC(=O)C2=CN=C(N=C21)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H18ClN3O2/c1-2-3-7-21-8-9-23-17(22)14-11-19-15(20-16(14)21)12-5-4-6-13(18)10-12/h4-6,10-11H,2-3,7-9H2,1H3