N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-cyanophenyl)benzamide

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-cyanophenyl)benzamide Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-cyanophenyl)benzamide CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-cyanophenyl)benzamide IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-cyanophenyl)benzamide Traditional Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-(2-cyanophenyl)benzamide Formula: C24H19ClN2O3 MolecularWeight: 418.87226

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC(=O)C3=CC=CC=C3C4=CC=CC=C4C#N)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC(=O)C3=CC=CC=C3C4=CC=CC=C4C#N)Cl)OC1

InChI

InChI=1S/C24H19ClN2O3/c25-21-12-16(13-22-23(21)30-11-5-10-29-22)15-27-24(28)20-9-4-3-8-19(20)18-7-2-1-6-17(18)14-26/h1-4,6-9,12-13H,5,10-11,15H2,(H,27,28)