4-tert-butyl-3-[3-(4-cyano-2-methoxy-phenyl)octanoylamino]benzamide

Systemtic Name: 4-tert-butyl-3-[3-(4-cyano-2-methoxy-phenyl)octanoylamino]benzamide Openeye Name: 4-tert-butyl-3-[3-(4-cyano-2-methoxy-phenyl)octanoylamino]benzamide CAS Name: 4-tert-butyl-3-[[3-(4-cyano-2-methoxyphenyl)-1-oxooctyl]amino]benzamide IUPAC Name: 4-tert-butyl-3-[3-(4-cyano-2-methoxyphenyl)octanoylamino]benzamide Traditional Name: 4-tert-butyl-3-[3-(4-cyano-2-methoxy-phenyl)octanoylamino]benzamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)C#N)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)C#N)OC

InChI

InChI=1S/C27H35N3O3/c1-6-7-8-9-19(21-12-10-18(17-28)14-24(21)33-5)16-25(31)30-23-15-20(26(29)32)11-13-22(23)27(2,3)4/h10-15,19H,6-9,16H2,1-5H3,(H2,29,32)(H,30,31)