(Z)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyridin-2-yl-prop-2-enenitrile

Systemtic Name: (Z)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyridin-2-yl-prop-2-enenitrile Openeye Name: (Z)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-pyridyl)prop-2-enenitrile CAS Name: (Z)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-pyridinyl)-2-propenenitrile IUPAC Name: (Z)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-pyridin-2-ylprop-2-enenitrile Traditional Name: (Z)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-pyridyl)acrylonitrile Formula: C17H13ClN2O2 MolecularWeight: 312.75032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C=C(C#N)C3=CC=CC=N3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)/C=C(\C#N)/C3=CC=CC=N3)Cl)OC1

InChI

InChI=1S/C17H13ClN2O2/c18-14-9-12(10-16-17(14)22-7-3-6-21-16)8-13(11-19)15-4-1-2-5-20-15/h1-2,4-5,8-10H,3,6-7H2/b13-8+