N-(3-ethanoylphenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-(3-acetylphenyl)-1-(o-tolylmethylsulfonyl)piperidine-4-carboxamide CAS Name: N-(3-acetylphenyl)-1-[(2-methylphenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-1-[(2-methylphenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-(3-acetylphenyl)-1-(2-methylbenzyl)sulfonyl-isonipecotamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H26N2O4S/c1-16-6-3-4-7-20(16)15-29(27,28)24-12-10-18(11-13-24)22(26)23-21-9-5-8-19(14-21)17(2)25/h3-9,14,18H,10-13,15H2,1-2H3,(H,23,26)