3-(9-chloranyl-6H-benzo[c][1,5]benzoxazepin-11-yl)propanenitrile

Systemtic Name: 3-(9-chloranyl-6H-benzo[c][1,5]benzoxazepin-11-yl)propanenitrile Openeye Name: 3-(9-chloro-6H-benzo[c][1,5]benzoxazepin-11-yl)propanenitrile CAS Name: 3-(9-chloro-6H-benzo[c][1,5]benzoxazepin-11-yl)propanenitrile IUPAC Name: 3-(9-chloro-6H-benzo[c][1,5]benzoxazepin-11-yl)propanenitrile Traditional Name: 3-(9-chloro-6H-benzo[c][1,5]benzoxazepin-11-yl)propionitrile Formula: C16H13ClN2O MolecularWeight: 284.74022

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=C(C=C2)Cl)N(C3=CC=CC=C3O1)CCC#N

Isomeric SMILES

C1C2=C(C=C(C=C2)Cl)N(C3=CC=CC=C3O1)CCC#N

InChI

InChI=1S/C16H13ClN2O/c17-13-7-6-12-11-20-16-5-2-1-4-14(16)19(9-3-8-18)15(12)10-13/h1-2,4-7,10H,3,9,11H2