N-(2-tert-butylphenyl)-3-[2-methoxy-4-(3-methylsulfonylpropoxy)phenyl]octanamide; N-methylmethanamide

Systemtic Name: N-(2-tert-butylphenyl)-3-[2-methoxy-4-(3-methylsulfonylpropoxy)phenyl]octanamide; N-methylmethanamide Openeye Name: N-(2-tert-butylphenyl)-3-[2-methoxy-4-(3-methylsulfonylpropoxy)phenyl]octanamide; N-methylformamide CAS Name: N-(2-tert-butylphenyl)-3-[2-methoxy-4-(3-methylsulfonylpropoxy)phenyl]octanamide; N-methylformamide IUPAC Name: N-(2-tert-butylphenyl)-3-[2-methoxy-4-(3-methylsulfonylpropoxy)phenyl]octanamide; N-methylformamide Traditional Name: N-(2-tert-butylphenyl)-3-[4-(3-mesylpropoxy)-2-methoxy-phenyl]caprylamide; N-methylformamide Formula: C31H48N2O6S MolecularWeight: 576.78762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)NC1=CC=CC=C1C(C)(C)C)C2=C(C=C(C=C2)OCCCS(=O)(=O)C)OC.CNC=O

Isomeric SMILES

CCCCCC(CC(=O)NC1=CC=CC=C1C(C)(C)C)C2=C(C=C(C=C2)OCCCS(=O)(=O)C)OC.CNC=O

InChI

InChI=1S/C29H43NO5S.C2H5NO/c1-7-8-9-13-22(20-28(31)30-26-15-11-10-14-25(26)29(2,3)4)24-17-16-23(21-27(24)34-5)35-18-12-19-36(6,32)33;1-3-2-4/h10-11,14-17,21-22H,7-9,12-13,18-20H2,1-6H3,(H,30,31);2H,1H3,(H,3,4)