N-cyano-N'-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-fluoranyl-2-(2-hydroxyethyl)benzenecarboximidamide

Systemtic Name: N-cyano-N'-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-fluoranyl-2-(2-hydroxyethyl)benzenecarboximidamide Openeye Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-3-fluoro-2-(2-hydroxyethyl)benzamidine CAS Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-fluoro-2-(2-hydroxyethyl)benzenecarboximidamide IUPAC Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-fluoro-2-(2-hydroxyethyl)benzenecarboximidamide Traditional Name: N-cyano-N'-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-3-fluoro-2-(2-hydroxyethyl)benzamidine Formula: C22H21FN4O3 MolecularWeight: 408.425543

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N=C(C3=C(C(=CC=C3)F)CCO)NC#N)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N=C(C3=C(C(=CC=C3)F)CCO)NC#N)O)C

InChI

InChI=1S/C22H21FN4O3/c1-22(2)20(29)19(16-10-13(11-24)6-7-18(16)30-22)27-21(26-12-25)15-4-3-5-17(23)14(15)8-9-28/h3-7,10,19-20,28-29H,8-9H2,1-2H3,(H,26,27)