2-oxidanyl-4-oxidanylidene-7-(4-phenylbutoxy)chromene-3-carbonitrile

Systemtic Name: 2-oxidanyl-4-oxidanylidene-7-(4-phenylbutoxy)chromene-3-carbonitrile Openeye Name: 2-hydroxy-4-oxo-7-(4-phenylbutoxy)chromene-3-carbonitrile CAS Name: 2-hydroxy-4-oxo-7-(4-phenylbutoxy)-1-benzopyran-3-carbonitrile IUPAC Name: 2-hydroxy-4-oxo-7-(4-phenylbutoxy)chromene-3-carbonitrile Traditional Name: 2-hydroxy-4-keto-7-(4-phenylbutoxy)chromene-3-carbonitrile Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC3=C(C=C2)C(=O)C(=C(O3)O)C#N

InChI

InChI=1S/C20H17NO4/c21-13-17-19(22)16-10-9-15(12-18(16)25-20(17)23)24-11-5-4-8-14-6-2-1-3-7-14/h1-3,6-7,9-10,12,23H,4-5,8,11H2