4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-N-(2-diethylaminoethyl)benzamide

Systemtic Name: 4-[2-(4-bromanyl-2-tert-butyl-phenoxy)ethanoylamino]-N-(2-diethylaminoethyl)benzamide Openeye Name: 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-N-(2-diethylaminoethyl)benzamide CAS Name: 4-[[2-(4-bromo-2-tert-butylphenoxy)-1-oxoethyl]amino]-N-(2-diethylaminoethyl)benzamide IUPAC Name: 4-[[2-(4-bromo-2-tert-butylphenoxy)acetyl]amino]-N-(2-diethylaminoethyl)benzamide Traditional Name: 4-[[2-(4-bromo-2-tert-butyl-phenoxy)acetyl]amino]-N-(2-diethylaminoethyl)benzamide Formula: C25H34BrN3O3 MolecularWeight: 504.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C(C)(C)C

InChI

InChI=1S/C25H34BrN3O3/c1-6-29(7-2)15-14-27-24(31)18-8-11-20(12-9-18)28-23(30)17-32-22-13-10-19(26)16-21(22)25(3,4)5/h8-13,16H,6-7,14-15,17H2,1-5H3,(H,27,31)(H,28,30)