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

Systemtic Name: N-(phenylmethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-benzyl-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-(phenylmethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-benzyl-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-benzyl-1-mesitylsulfonyl-nipecotamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C22H28N2O3S/c1-16-12-17(2)21(18(3)13-16)28(26,27)24-11-7-10-20(15-24)22(25)23-14-19-8-5-4-6-9-19/h4-6,8-9,12-13,20H,7,10-11,14-15H2,1-3H3,(H,23,25)