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

Systemtic Name: 4-tert-butyl-3-[3-(2-methoxy-4-phenylmethoxy-phenyl)octanoylamino]benzamide Openeye Name: 3-[3-(4-benzyloxy-2-methoxy-phenyl)octanoylamino]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-3-[[3-(2-methoxy-4-phenylmethoxyphenyl)-1-oxooctyl]amino]benzamide IUPAC Name: 4-tert-butyl-3-[3-(2-methoxy-4-phenylmethoxyphenyl)octanoylamino]benzamide Traditional Name: 3-[3-(4-benzoxy-2-methoxy-phenyl)octanoylamino]-4-tert-butyl-benzamide Formula: C33H42N2O4 MolecularWeight: 530.69758

Click to see the large picture

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)OCC3=CC=CC=C3)OC

Isomeric SMILES

CCCCCC(CC(=O)NC1=C(C=CC(=C1)C(=O)N)C(C)(C)C)C2=C(C=C(C=C2)OCC3=CC=CC=C3)OC

InChI

InChI=1S/C33H42N2O4/c1-6-7-9-14-24(20-31(36)35-29-19-25(32(34)37)15-18-28(29)33(2,3)4)27-17-16-26(21-30(27)38-5)39-22-23-12-10-8-11-13-23/h8,10-13,15-19,21,24H,6-7,9,14,20,22H2,1-5H3,(H2,34,37)(H,35,36)