3-(2-adamantylidene)-5,5-dicyano-2-[1-(2,5-dimethylfuran-3-yl)ethylidene]-4-oxidanyl-pent-4-enoic acid

Systemtic Name: 3-(2-adamantylidene)-5,5-dicyano-2-[1-(2,5-dimethylfuran-3-yl)ethylidene]-4-oxidanyl-pent-4-enoic acid Openeye Name: 3-(2-adamantylidene)-5,5-dicyano-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-4-hydroxy-pent-4-enoic acid CAS Name: 3-(2-adamantylidene)-5,5-dicyano-2-[1-(2,5-dimethyl-3-furanyl)ethylidene]-4-hydroxy-4-pentenoic acid IUPAC Name: 3-(2-adamantylidene)-5,5-dicyano-2-[1-(2,5-dimethylfuran-3-yl)ethylidene]-4-hydroxypent-4-enoic acid Traditional Name: 3-(2-adamantylidene)-5,5-dicyano-2-[1-(2,5-dimethyl-3-furyl)ethylidene]-4-hydroxy-pent-4-enoic acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=C(C(=C2C3CC4CC(C3)CC2C4)C(=C(C#N)C#N)O)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(O1)C)C(=C(C(=C2C3CC4CC(C3)CC2C4)C(=C(C#N)C#N)O)C(=O)O)C

InChI

InChI=1S/C25H26N2O4/c1-12-4-20(14(3)31-12)13(2)21(25(29)30)23(24(28)19(10-26)11-27)22-17-6-15-5-16(8-17)9-18(22)7-15/h4,15-18,28H,5-9H2,1-3H3,(H,29,30)