(5aS)-8,10-bis(chloranyl)-6-ethyl-1,2,3,4,5,5a-hexahydro-[1,4]diazepino[1,7-a]quinazolin-7-one

Systemtic Name: (5aS)-8,10-bis(chloranyl)-6-ethyl-1,2,3,4,5,5a-hexahydro-[1,4]diazepino[1,7-a]quinazolin-7-one Openeye Name: (5aS)-8,10-dichloro-6-ethyl-1,2,3,4,5,5a-hexahydro-[1,4]diazepino[1,7-a]quinazolin-7-one CAS Name: (5aS)-8,10-dichloro-6-ethyl-1,2,3,4,5,5a-hexahydro-[1,4]diazepino[1,7-a]quinazolin-7-one IUPAC Name: (5aS)-8,10-dichloro-6-ethyl-1,2,3,4,5,5a-hexahydro-[1,4]diazepino[1,7-a]quinazolin-7-one Traditional Name: (5aS)-8,10-dichloro-6-ethyl-1,2,3,4,5,5a-hexahydro-[1,4]diazepino[1,7-a]quinazolin-7-one Formula: C14H17Cl2N3O MolecularWeight: 314.21028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2CCNCCN2C3=CC(=CC(=C3C1=O)Cl)Cl

Isomeric SMILES

CCN1[C@H]2CCNCCN2C3=CC(=CC(=C3C1=O)Cl)Cl

InChI

InChI=1S/C14H17Cl2N3O/c1-2-18-12-3-4-17-5-6-19(12)11-8-9(15)7-10(16)13(11)14(18)20/h7-8,12,17H,2-6H2,1H3/t12-/m1/s1