4-tert-butyl-3-[3-(2-ethoxy-4-methoxy-phenyl)heptanoylamino]benzamide

Systemtic Name: 4-tert-butyl-3-[3-(2-ethoxy-4-methoxy-phenyl)heptanoylamino]benzamide Openeye Name: 4-tert-butyl-3-[3-(2-ethoxy-4-methoxy-phenyl)heptanoylamino]benzamide CAS Name: 4-tert-butyl-3-[[3-(2-ethoxy-4-methoxyphenyl)-1-oxoheptyl]amino]benzamide IUPAC Name: 4-tert-butyl-3-[3-(2-ethoxy-4-methoxyphenyl)heptanoylamino]benzamide Traditional Name: 4-tert-butyl-3-[3-(2-ethoxy-4-methoxy-phenyl)heptanoylamino]benzamide Formula: C27H38N2O4 MolecularWeight: 454.60162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)OC)OCC

Isomeric SMILES

CCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)OC)OCC

InChI

InChI=1S/C27H38N2O4/c1-7-9-10-18(21-13-12-20(32-6)17-24(21)33-8-2)16-25(30)29-23-15-19(26(28)31)11-14-22(23)27(3,4)5/h11-15,17-18H,7-10,16H2,1-6H3,(H2,28,31)(H,29,30)