N-[2-chloranyl-5-(hexadecylsulfonylamino)phenyl]-4,4-dimethyl-2-(4-methylphenoxy)-3-oxidanylidene-pentanamide

Systemtic Name: N-[2-chloranyl-5-(hexadecylsulfonylamino)phenyl]-4,4-dimethyl-2-(4-methylphenoxy)-3-oxidanylidene-pentanamide Openeye Name: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-4,4-dimethyl-2-(4-methylphenoxy)-3-oxo-pentanamide CAS Name: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-4,4-dimethyl-2-(4-methylphenoxy)-3-oxopentanamide IUPAC Name: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-4,4-dimethyl-2-(4-methylphenoxy)-3-oxopentanamide Traditional Name: N-[5-(cetylsulfonylamino)-2-chloro-phenyl]-3-keto-4,4-dimethyl-2-(4-methylphenoxy)valeramide Formula: C36H55ClN2O5S MolecularWeight: 663.3503

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)OC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(C(=O)C(C)(C)C)OC2=CC=C(C=C2)C

InChI

InChI=1S/C36H55ClN2O5S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26-45(42,43)39-29-22-25-31(37)32(27-29)38-35(41)33(34(40)36(3,4)5)44-30-23-20-28(2)21-24-30/h20-25,27,33,39H,6-19,26H2,1-5H3,(H,38,41)