3-chloranyl-6-hexyl-9-methyl-pyridazino[3,4-b][1,5]benzoxazepin-5-one

Systemtic Name: 3-chloranyl-6-hexyl-9-methyl-pyridazino[3,4-b][1,5]benzoxazepin-5-one Openeye Name: 3-chloro-6-hexyl-9-methyl-pyridazino[3,4-b][1,5]benzoxazepin-5-one CAS Name: 3-chloro-6-hexyl-9-methyl-5-pyridazino[3,4-b][1,5]benzoxazepinone IUPAC Name: 3-chloro-6-hexyl-9-methylpyridazino[3,4-b][1,5]benzoxazepin-5-one Traditional Name: 3-chloro-6-hexyl-9-methyl-pyridazino[3,4-b][1,5]benzoxazepin-5-one Formula: C18H20ClN3O2 MolecularWeight: 345.8233

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=C(C=C(C=C2)C)OC3=NN=C(C=C3C1=O)Cl

Isomeric SMILES

CCCCCCN1C2=C(C=C(C=C2)C)OC3=NN=C(C=C3C1=O)Cl

InChI

InChI=1S/C18H20ClN3O2/c1-3-4-5-6-9-22-14-8-7-12(2)10-15(14)24-17-13(18(22)23)11-16(19)20-21-17/h7-8,10-11H,3-6,9H2,1-2H3