2-[[2-(4-butoxyphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methylamino]benzenecarbonitrile

Systemtic Name: 2-[[2-(4-butoxyphenyl)-5-oxidanylidene-1,3-oxazol-4-ylidene]methylamino]benzenecarbonitrile Openeye Name: 2-[[2-(4-butoxyphenyl)-5-oxo-oxazol-4-ylidene]methylamino]benzonitrile CAS Name: 2-[[2-(4-butoxyphenyl)-5-oxo-4-oxazolylidene]methylamino]benzonitrile IUPAC Name: 2-[[2-(4-butoxyphenyl)-5-oxo-1,3-oxazol-4-ylidene]methylamino]benzonitrile Traditional Name: 2-[[2-(4-butoxyphenyl)-5-keto-2-oxazolin-4-ylidene]methylamino]benzonitrile Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC(=CNC3=CC=CC=C3C#N)C(=O)O2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC(=CNC3=CC=CC=C3C#N)C(=O)O2

InChI

InChI=1S/C21H19N3O3/c1-2-3-12-26-17-10-8-15(9-11-17)20-24-19(21(25)27-20)14-23-18-7-5-4-6-16(18)13-22/h4-11,14,23H,2-3,12H2,1H3