3-chloranyl-11-[6-(diethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 3-chloranyl-11-[6-(diethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-chloro-11-[6-(diethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one CAS Name: 3-chloro-11-[6-(diethylamino)-1-oxohexyl]-5H-benzo[b][1,4]benzodiazepin-6-one IUPAC Name: 3-chloro-11-[6-(diethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-chloro-11-[6-(diethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCCCC(=O)N1C2=C(C=C(C=C2)Cl)NC(=O)C3=CC=CC=C31

Isomeric SMILES

CCN(CC)CCCCCC(=O)N1C2=C(C=C(C=C2)Cl)NC(=O)C3=CC=CC=C31

InChI

InChI=1S/C23H28ClN3O2/c1-3-26(4-2)15-9-5-6-12-22(28)27-20-11-8-7-10-18(20)23(29)25-19-16-17(24)13-14-21(19)27/h7-8,10-11,13-14,16H,3-6,9,12,15H2,1-2H3,(H,25,29)