4-(5,7-dibutoxy-2-oxidanylidene-chromen-3-yl)carbonylbenzenecarbonitrile

Systemtic Name: 4-(5,7-dibutoxy-2-oxidanylidene-chromen-3-yl)carbonylbenzenecarbonitrile Openeye Name: 4-(5,7-dibutoxy-2-oxo-chromene-3-carbonyl)benzonitrile CAS Name: 4-[(5,7-dibutoxy-2-oxo-1-benzopyran-3-yl)-oxomethyl]benzonitrile IUPAC Name: 4-(5,7-dibutoxy-2-oxochromene-3-carbonyl)benzonitrile Traditional Name: 4-(5,7-dibutoxy-2-keto-chromene-3-carbonyl)benzonitrile Formula: C25H25NO5 MolecularWeight: 419.4697

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C2C=C(C(=O)OC2=C1)C(=O)C3=CC=C(C=C3)C#N)OCCCC

Isomeric SMILES

CCCCOC1=CC(=C2C=C(C(=O)OC2=C1)C(=O)C3=CC=C(C=C3)C#N)OCCCC

InChI

InChI=1S/C25H25NO5/c1-3-5-11-29-19-13-22(30-12-6-4-2)20-15-21(25(28)31-23(20)14-19)24(27)18-9-7-17(16-26)8-10-18/h7-10,13-15H,3-6,11-12H2,1-2H3