N-[(4-cyano-2-oxidanyl-phenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide

Systemtic Name: N-[(4-cyano-2-oxidanyl-phenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxidanylidene-1H-isoindol-2-yl)ethanamide Openeye Name: N-[(4-cyano-2-hydroxy-phenyl)methyl]-2-ethoxy-2-(4-methyl-1-oxo-isoindolin-2-yl)acetamide CAS Name: N-[(4-cyano-2-hydroxyphenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxo-1H-isoindol-2-yl)acetamide IUPAC Name: N-[(4-cyano-2-hydroxyphenyl)methyl]-2-ethoxy-2-(7-methyl-3-oxo-1H-isoindol-2-yl)acetamide Traditional Name: N-(4-cyano-2-hydroxy-benzyl)-2-ethoxy-2-(1-keto-4-methyl-isoindolin-2-yl)acetamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C(=O)NCC1=C(C=C(C=C1)C#N)O)N2CC3=C(C2=O)C=CC=C3C

Isomeric SMILES

CCOC(C(=O)NCC1=C(C=C(C=C1)C#N)O)N2CC3=C(C2=O)C=CC=C3C

InChI

InChI=1S/C21H21N3O4/c1-3-28-21(24-12-17-13(2)5-4-6-16(17)20(24)27)19(26)23-11-15-8-7-14(10-22)9-18(15)25/h4-9,21,25H,3,11-12H2,1-2H3,(H,23,26)