3-(6-chloranyl-4H-1,3-benzodioxin-8-yl)-2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-2-cyano-N-phenethyl-propanamide

Systemtic Name: 3-(6-chloranyl-4H-1,3-benzodioxin-8-yl)-2-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methyl]-2-cyano-N-phenethyl-propanamide Openeye Name: 3-(6-chloro-4H-1,3-benzodioxin-8-yl)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-2-cyano-N-phenethyl-propanamide CAS Name: 3-(6-chloro-4H-1,3-benzodioxin-8-yl)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-2-cyano-N-phenethylpropanamide IUPAC Name: 3-(6-chloro-4H-1,3-benzodioxin-8-yl)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-2-cyano-N-phenethylpropanamide Traditional Name: 3-(6-chloro-4H-1,3-benzodioxin-8-yl)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methyl]-2-cyano-N-phenethyl-propionamide Formula: C29H26Cl2N2O5 MolecularWeight: 553.43314

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CC(CC3=C4C(=CC(=C3)Cl)COCO4)(C#N)C(=O)NCCC5=CC=CC=C5)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CC(CC3=C4C(=CC(=C3)Cl)COCO4)(C#N)C(=O)NCCC5=CC=CC=C5)Cl

InChI

InChI=1S/C29H26Cl2N2O5/c30-24-8-20(26-22(10-24)14-35-17-37-26)12-29(16-32,28(34)33-7-6-19-4-2-1-3-5-19)13-21-9-25(31)11-23-15-36-18-38-27(21)23/h1-5,8-11H,6-7,12-15,17-18H2,(H,33,34)