3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzenecarbonitrile

Systemtic Name: 3-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzenecarbonitrile Openeye Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzonitrile CAS Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzonitrile IUPAC Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzonitrile Traditional Name: 3-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methoxy]benzonitrile Formula: C17H14ClNO3 MolecularWeight: 315.75096

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)COC3=CC=CC(=C3)C#N)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)COC3=CC=CC(=C3)C#N)Cl)OC1

InChI

InChI=1S/C17H14ClNO3/c18-15-8-13(9-16-17(15)21-6-2-5-20-16)11-22-14-4-1-3-12(7-14)10-19/h1,3-4,7-9H,2,5-6,11H2