5-azanyl-2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-cyanophenyl)benzamide

Systemtic Name: 5-azanyl-2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-cyanophenyl)benzamide Openeye Name: 5-amino-2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-N-(4-cyanophenyl)benzamide CAS Name: 5-amino-2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-cyanophenyl)benzamide IUPAC Name: 5-amino-2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-(4-cyanophenyl)benzamide Traditional Name: 5-amino-N-(4-cyanophenyl)-2-(2,4-ditert-amylphenoxy)benzamide Formula: C30H35N3O2 MolecularWeight: 469.6178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)N)C(=O)NC3=CC=C(C=C3)C#N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)N)C(=O)NC3=CC=C(C=C3)C#N)C(C)(C)CC

InChI

InChI=1S/C30H35N3O2/c1-7-29(3,4)21-11-15-27(25(17-21)30(5,6)8-2)35-26-16-12-22(32)18-24(26)28(34)33-23-13-9-20(19-31)10-14-23/h9-18H,7-8,32H2,1-6H3,(H,33,34)