4-bromanyl-N-[(4-methylsulfonylphenyl)methyl]-N-(2-oxidanylhexyl)-2-(phenylcarbonyl)benzamide

Systemtic Name: 4-bromanyl-N-[(4-methylsulfonylphenyl)methyl]-N-(2-oxidanylhexyl)-2-(phenylcarbonyl)benzamide Openeye Name: 2-benzoyl-4-bromo-N-(2-hydroxyhexyl)-N-[(4-methylsulfonylphenyl)methyl]benzamide CAS Name: 2-benzoyl-4-bromo-N-(2-hydroxyhexyl)-N-[(4-methylsulfonylphenyl)methyl]benzamide IUPAC Name: 2-benzoyl-4-bromo-N-(2-hydroxyhexyl)-N-[(4-methylsulfonylphenyl)methyl]benzamide Traditional Name: 2-benzoyl-4-bromo-N-(2-hydroxyhexyl)-N-(4-mesylbenzyl)benzamide Formula: C28H30BrNO5S MolecularWeight: 572.5105

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CN(CC1=CC=C(C=C1)S(=O)(=O)C)C(=O)C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3)O

Isomeric SMILES

CCCCC(CN(CC1=CC=C(C=C1)S(=O)(=O)C)C(=O)C2=C(C=C(C=C2)Br)C(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C28H30BrNO5S/c1-3-4-10-23(31)19-30(18-20-11-14-24(15-12-20)36(2,34)35)28(33)25-16-13-22(29)17-26(25)27(32)21-8-6-5-7-9-21/h5-9,11-17,23,31H,3-4,10,18-19H2,1-2H3