N-methyl-N-(3-phenoxypropyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-methyl-N-(3-phenoxypropyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-methyl-N-(3-phenoxypropyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-methyl-N-(3-phenoxypropyl)-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-methyl-N-(3-phenoxypropyl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: 1-mesitylsulfonyl-N-methyl-N-(3-phenoxypropyl)isonipecotamide Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CCCOC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CCCOC3=CC=CC=C3)C

InChI

InChI=1S/C25H34N2O4S/c1-19-17-20(2)24(21(3)18-19)32(29,30)27-14-11-22(12-15-27)25(28)26(4)13-8-16-31-23-9-6-5-7-10-23/h5-7,9-10,17-18,22H,8,11-16H2,1-4H3