2-butoxy-N-[5-[(2-butoxy-5-ethynyl-phenyl)carbonylamino]-2,4-bis(2-methylpropoxy)phenyl]-5-ethynyl-benzamide

Systemtic Name: 2-butoxy-N-[5-[(2-butoxy-5-ethynyl-phenyl)carbonylamino]-2,4-bis(2-methylpropoxy)phenyl]-5-ethynyl-benzamide Openeye Name: 2-butoxy-N-[5-[(2-butoxy-5-ethynyl-benzoyl)amino]-2,4-diisobutoxy-phenyl]-5-ethynyl-benzamide CAS Name: 2-butoxy-N-[5-[[(2-butoxy-5-ethynylphenyl)-oxomethyl]amino]-2,4-bis(2-methylpropoxy)phenyl]-5-ethynylbenzamide IUPAC Name: 2-butoxy-N-[5-[(2-butoxy-5-ethynylbenzoyl)amino]-2,4-bis(2-methylpropoxy)phenyl]-5-ethynylbenzamide Traditional Name: 2-butoxy-N-[5-[(2-butoxy-5-ethynyl-benzoyl)amino]-2,4-diisobutoxy-phenyl]-5-ethynyl-benzamide Formula: C40H48N2O6 MolecularWeight: 652.81892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C#C)C(=O)NC2=CC(=C(C=C2OCC(C)C)OCC(C)C)NC(=O)C3=C(C=CC(=C3)C#C)OCCCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C#C)C(=O)NC2=CC(=C(C=C2OCC(C)C)OCC(C)C)NC(=O)C3=C(C=CC(=C3)C#C)OCCCC

InChI

InChI=1S/C40H48N2O6/c1-9-13-19-45-35-17-15-29(11-3)21-31(35)39(43)41-33-23-34(38(48-26-28(7)8)24-37(33)47-25-27(5)6)42-40(44)32-22-30(12-4)16-18-36(32)46-20-14-10-2/h3-4,15-18,21-24,27-28H,9-10,13-14,19-20,25-26H2,1-2,5-8H3,(H,41,43)(H,42,44)