7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-2-oxidanyl-4-oxidanylidene-8-propyl-chromene-3-carbonitrile

Systemtic Name: 7-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-2-oxidanyl-4-oxidanylidene-8-propyl-chromene-3-carbonitrile Openeye Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-hydroxy-4-oxo-8-propyl-chromene-3-carbonitrile CAS Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-hydroxy-4-oxo-8-propyl-1-benzopyran-3-carbonitrile IUPAC Name: 7-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-hydroxy-4-oxo-8-propylchromene-3-carbonitrile Traditional Name: 7-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-hydroxy-4-keto-8-propyl-chromene-3-carbonitrile Formula: C27H29NO7 MolecularWeight: 479.52166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(C=C2)C(=O)C(=C(O3)O)C#N)CCC

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=C(C3=C(C=C2)C(=O)C(=C(O3)O)C#N)CCC

InChI

InChI=1S/C27H29NO7/c1-4-7-18-22(11-9-17(16(3)29)24(18)30)33-13-6-14-34-23-12-10-20-25(31)21(15-28)27(32)35-26(20)19(23)8-5-2/h9-12,30,32H,4-8,13-14H2,1-3H3