(Z)-N-(2-adamantyl)-4-(4-methoxyphenyl)-4-oxidanyl-2-oxidanylidene-but-3-enamide

Systemtic Name: (Z)-N-(2-adamantyl)-4-(4-methoxyphenyl)-4-oxidanyl-2-oxidanylidene-but-3-enamide Openeye Name: (Z)-N-(2-adamantyl)-4-hydroxy-4-(4-methoxyphenyl)-2-oxo-but-3-enamide CAS Name: (Z)-N-(2-adamantyl)-4-hydroxy-4-(4-methoxyphenyl)-2-oxo-3-butenamide IUPAC Name: (Z)-N-(2-adamantyl)-4-hydroxy-4-(4-methoxyphenyl)-2-oxobut-3-enamide Traditional Name: (Z)-N-(2-adamantyl)-4-hydroxy-2-keto-4-(4-methoxyphenyl)but-3-enamide Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=CC(=O)C(=O)NC2C3CC4CC(C3)CC2C4)O

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C/C(=O)C(=O)NC2C3CC4CC(C3)CC2C4)/O

InChI

InChI=1S/C21H25NO4/c1-26-17-4-2-14(3-5-17)18(23)11-19(24)21(25)22-20-15-7-12-6-13(9-15)10-16(20)8-12/h2-5,11-13,15-16,20,23H,6-10H2,1H3,(H,22,25)/b18-11-