phenyl oxidanylidene-[[3-oxidanylidene-1-phenyl-2-(phenylmethyl)hexyl]amino]methanesulfonate

Systemtic Name: phenyl oxidanylidene-[[3-oxidanylidene-1-phenyl-2-(phenylmethyl)hexyl]amino]methanesulfonate Openeye Name: phenyl [(2-benzyl-3-oxo-1-phenyl-hexyl)amino]-oxo-methanesulfonate CAS Name: oxo-[[3-oxo-1-phenyl-2-(phenylmethyl)hexyl]amino]methanesulfonic acid phenyl ester IUPAC Name: phenyl [(2-benzyl-3-oxo-1-phenylhexyl)amino]-oxomethanesulfonate Traditional Name: [(2-benzyl-3-keto-1-phenyl-hexyl)amino]-keto-methanesulfonic acid phenyl ester Formula: C26H27NO5S MolecularWeight: 465.56128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC1=CC=CC=C1)C(C2=CC=CC=C2)NC(=O)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)C(CC1=CC=CC=C1)C(C2=CC=CC=C2)NC(=O)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C26H27NO5S/c1-2-12-24(28)23(19-20-13-6-3-7-14-20)25(21-15-8-4-9-16-21)27-26(29)33(30,31)32-22-17-10-5-11-18-22/h3-11,13-18,23,25H,2,12,19H2,1H3,(H,27,29)