N-[2-(3-methylphenoxy)ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3-methylphenoxy)ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3-methylphenoxy)ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(3-methylphenoxy)ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(3-methylphenoxy)ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3-methylphenoxy)ethyl]-1-(2,3,5,6-tetramethylphenyl)sulfonyl-isonipecotamide Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C(=CC(=C3C)C)C)C

InChI

InChI=1S/C25H34N2O4S/c1-17-7-6-8-23(15-17)31-14-11-26-25(28)22-9-12-27(13-10-22)32(29,30)24-20(4)18(2)16-19(3)21(24)5/h6-8,15-16,22H,9-14H2,1-5H3,(H,26,28)