N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Openeye Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-5-methyl-3-phenyl-isoxazole-4-carboxamide CAS Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-5-methyl-3-phenyl-4-isoxazolecarboxamide IUPAC Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide Traditional Name: N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-5-methyl-3-phenyl-isoxazole-4-carboxamide Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C(C(OC4=C3C=C(C=C4)C#N)(C)C)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3C(C(OC4=C3C=C(C=C4)C#N)(C)C)O

InChI

InChI=1S/C23H21N3O4/c1-13-18(19(26-30-13)15-7-5-4-6-8-15)22(28)25-20-16-11-14(12-24)9-10-17(16)29-23(2,3)21(20)27/h4-11,20-21,27H,1-3H3,(H,25,28)