2-butyl-1,3-diethoxy-4-oxidanylidene-cyclobut-2-ene-1-carbonitrile

Systemtic Name: 2-butyl-1,3-diethoxy-4-oxidanylidene-cyclobut-2-ene-1-carbonitrile Openeye Name: 2-butyl-1,3-diethoxy-4-oxo-cyclobut-2-ene-1-carbonitrile CAS Name: 2-butyl-1,3-diethoxy-4-oxo-1-cyclobut-2-enecarbonitrile IUPAC Name: 2-butyl-1,3-diethoxy-4-oxocyclobut-2-ene-1-carbonitrile Traditional Name: 2-butyl-1,3-diethoxy-4-keto-cyclobut-2-ene-1-carbonitrile Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C1(C#N)OCC)OCC

Isomeric SMILES

CCCCC1=C(C(=O)C1(C#N)OCC)OCC

InChI

InChI=1S/C13H19NO3/c1-4-7-8-10-11(16-5-2)12(15)13(10,9-14)17-6-3/h4-8H2,1-3H3