2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-4-(4-phenylmethoxyphenyl)butanenitrile

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-4-(4-phenylmethoxyphenyl)butanenitrile Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-(4-benzyloxyphenyl)-4-oxo-butanenitrile CAS Name: 2-(1,3-benzodioxol-5-yl)-4-oxo-4-(4-phenylmethoxyphenyl)butanenitrile IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-oxo-4-(4-phenylmethoxyphenyl)butanenitrile Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-(4-benzoxyphenyl)-4-keto-butyronitrile Formula: C24H19NO4 MolecularWeight: 385.41196

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N

InChI

InChI=1S/C24H19NO4/c25-14-20(19-8-11-23-24(13-19)29-16-28-23)12-22(26)18-6-9-21(10-7-18)27-15-17-4-2-1-3-5-17/h1-11,13,20H,12,15-16H2