1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(3-ethanoylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(3-ethanoylphenyl)piperidine-3-carboxamide Openeye Name: N-(3-acetylphenyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide CAS Name: N-(3-acetylphenyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Traditional Name: N-(3-acetylphenyl)-1-(2,6-dichlorobenzyl)sulfonyl-nipecotamide Formula: C21H22Cl2N2O4S MolecularWeight: 469.38138

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H22Cl2N2O4S/c1-14(26)15-5-2-7-17(11-15)24-21(27)16-6-4-10-25(12-16)30(28,29)13-18-19(22)8-3-9-20(18)23/h2-3,5,7-9,11,16H,4,6,10,12-13H2,1H3,(H,24,27)