N-[2-[[cyano-(3-hydroxyphenyl)methyl]carbamoyl]cyclohexyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-[[cyano-(3-hydroxyphenyl)methyl]carbamoyl]cyclohexyl]-4-fluoranyl-benzamide Openeye Name: N-[2-[[cyano-(3-hydroxyphenyl)methyl]carbamoyl]cyclohexyl]-4-fluoro-benzamide CAS Name: N-[2-[[[cyano-(3-hydroxyphenyl)methyl]amino]-oxomethyl]cyclohexyl]-4-fluorobenzamide IUPAC Name: N-[2-[[cyano-(3-hydroxyphenyl)methyl]carbamoyl]cyclohexyl]-4-fluorobenzamide Traditional Name: N-[2-[[cyano-(3-hydroxyphenyl)methyl]carbamoyl]cyclohexyl]-4-fluoro-benzamide Formula: C22H22FN3O3 MolecularWeight: 395.426783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC(C#N)C2=CC(=CC=C2)O)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCC(C(C1)C(=O)NC(C#N)C2=CC(=CC=C2)O)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FN3O3/c23-16-10-8-14(9-11-16)21(28)25-19-7-2-1-6-18(19)22(29)26-20(13-24)15-4-3-5-17(27)12-15/h3-5,8-12,18-20,27H,1-2,6-7H2,(H,25,28)(H,26,29)