N-(3-chloranyl-4-cyano-phenyl)-4-(4-methoxyphenyl)-2-(oxan-4-yl)-2-oxidanyl-but-3-ynamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-4-(4-methoxyphenyl)-2-(oxan-4-yl)-2-oxidanyl-but-3-ynamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-hydroxy-4-(4-methoxyphenyl)-2-tetrahydropyran-4-yl-but-3-ynamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-hydroxy-4-(4-methoxyphenyl)-2-(4-oxanyl)-3-butynamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-hydroxy-4-(4-methoxyphenyl)-2-(oxan-4-yl)but-3-ynamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-hydroxy-4-(4-methoxyphenyl)-2-tetrahydropyran-4-yl-but-3-ynamide Formula: C23H21ClN2O4 MolecularWeight: 424.87684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC(C2CCOCC2)(C(=O)NC3=CC(=C(C=C3)C#N)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)C#CC(C2CCOCC2)(C(=O)NC3=CC(=C(C=C3)C#N)Cl)O

InChI

InChI=1S/C23H21ClN2O4/c1-29-20-6-2-16(3-7-20)8-11-23(28,18-9-12-30-13-10-18)22(27)26-19-5-4-17(15-25)21(24)14-19/h2-7,14,18,28H,9-10,12-13H2,1H3,(H,26,27)