2-(2-chloranylhexadecan-5-ylsulfonylamino)-4,4-dimethyl-3-oxidanylidene-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide

Systemtic Name: 2-(2-chloranylhexadecan-5-ylsulfonylamino)-4,4-dimethyl-3-oxidanylidene-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide Openeye Name: 2-[4-(4-benzyloxyphenyl)sulfonylphenoxy]-2-[1-(3-chlorobutyl)dodecylsulfonylamino]-4,4-dimethyl-3-oxo-N-phenyl-pentanamide CAS Name: 2-(2-chlorohexadecan-5-ylsulfonylamino)-4,4-dimethyl-3-oxo-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide IUPAC Name: 2-(2-chlorohexadecan-5-ylsulfonylamino)-4,4-dimethyl-3-oxo-N-phenyl-2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]pentanamide Traditional Name: 2-[4-(4-benzoxyphenyl)sulfonylphenoxy]-2-[1-(3-chlorobutyl)dodecylsulfonylamino]-3-keto-4,4-dimethyl-N-phenyl-valeramide Formula: C48H63ClN2O8S2 MolecularWeight: 895.60542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCC(C)Cl)S(=O)(=O)NC(C(=O)C(C)(C)C)(C(=O)NC1=CC=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCCCC(CCC(C)Cl)S(=O)(=O)NC(C(=O)C(C)(C)C)(C(=O)NC1=CC=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C48H63ClN2O8S2/c1-6-7-8-9-10-11-12-13-20-25-44(31-26-37(2)49)61(56,57)51-48(45(52)47(3,4)5,46(53)50-39-23-18-15-19-24-39)59-41-29-34-43(35-30-41)60(54,55)42-32-27-40(28-33-42)58-36-38-21-16-14-17-22-38/h14-19,21-24,27-30,32-35,37,44,51H,6-13,20,25-26,31,36H2,1-5H3,(H,50,53)