(E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(2-pyridylmethyl)acrylamide Formula: C18H17ClN2O3 MolecularWeight: 344.79218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)C=CC(=O)NCC3=CC=CC=N3)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)/C=C/C(=O)NCC3=CC=CC=N3)Cl)OC1

InChI

InChI=1S/C18H17ClN2O3/c19-15-10-13(11-16-18(15)24-9-3-8-23-16)5-6-17(22)21-12-14-4-1-2-7-20-14/h1-2,4-7,10-11H,3,8-9,12H2,(H,21,22)/b6-5+