1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[(2,6-dichlorophenyl)methylsulfonyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[(2,6-dichlorophenyl)methylsulfonyl]-N-(4-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[(2,6-dichlorophenyl)methylsulfonyl]-N-(4-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(2,6-dichlorobenzyl)sulfonyl-N-(4-methoxyphenyl)isonipecotamide Formula: C20H22Cl2N2O4S MolecularWeight: 457.37068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C20H22Cl2N2O4S/c1-28-16-7-5-15(6-8-16)23-20(25)14-9-11-24(12-10-14)29(26,27)13-17-18(21)3-2-4-19(17)22/h2-8,14H,9-13H2,1H3,(H,23,25)