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

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

Systemtic Name:3-chloranyl-11-[6-(ethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one
Openeye Name:3-chloro-11-[6-(ethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one
CAS Name:3-chloro-11-[6-(ethylamino)-1-oxohexyl]-5H-benzo[b][1,4]benzodiazepin-6-one
IUPAC Name:3-chloro-11-[6-(ethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one
Traditional Name:3-chloro-11-[6-(ethylamino)hexanoyl]-5H-benzo[b][1,4]benzodiazepin-6-one
Formula: C21H24ClN3O2
MolecularWeight: 385.88716
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

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


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