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

Systemtic Name: 3-chloranyl-11-[4-(diethylamino)butanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 3-chloro-11-[4-(diethylamino)butanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one CAS Name: 3-chloro-11-[4-(diethylamino)-1-oxobutyl]-5H-benzo[b][1,4]benzodiazepin-6-one IUPAC Name: 3-chloro-11-[4-(diethylamino)butanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Traditional Name: 3-chloro-11-[4-(diethylamino)butanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one Formula: C21H24ClN3O2 MolecularWeight: 385.88716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClN3O2/c1-3-24(4-2)13-7-10-20(26)25-18-9-6-5-8-16(18)21(27)23-17-14-15(22)11-12-19(17)25/h5-6,8-9,11-12,14H,3-4,7,10,13H2,1-2H3,(H,23,27)