4-[[(4-bromophenyl)carbonylamino]methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide

Systemtic Name: 4-[[(4-bromophenyl)carbonylamino]methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Openeye Name: 4-[[(4-bromobenzoyl)amino]methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide CAS Name: 4-[[[(4-bromophenyl)-oxomethyl]amino]methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide IUPAC Name: 4-[[(4-bromobenzoyl)amino]methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide Traditional Name: 4-[[(4-bromobenzoyl)amino]methyl]-N-homoveratryl-benzamide Formula: C25H25BrN2O4 MolecularWeight: 497.381

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)CNC(=O)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C25H25BrN2O4/c1-31-22-12-5-17(15-23(22)32-2)13-14-27-24(29)19-6-3-18(4-7-19)16-28-25(30)20-8-10-21(26)11-9-20/h3-12,15H,13-14,16H2,1-2H3,(H,27,29)(H,28,30)