4-(2-phenylethynyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(2-phenylethynyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(2-phenylethynyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-(2-phenylethynyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(2-phenylethynyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-(2-phenylethynyl)-N-(3,4,5-trimethoxybenzyl)benzamide Formula: C25H23NO4 MolecularWeight: 401.45442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C25H23NO4/c1-28-22-15-20(16-23(29-2)24(22)30-3)17-26-25(27)21-13-11-19(12-14-21)10-9-18-7-5-4-6-8-18/h4-8,11-16H,17H2,1-3H3,(H,26,27)