1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(3-piperidin-1-ylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(3-piperidin-1-ylpropyl)piperidine-4-carboxamide Openeye Name: 1-[(2,6-dichlorophenyl)methylsulfonyl]-N-[3-(1-piperidyl)propyl]piperidine-4-carboxamide CAS Name: 1-[(2,6-dichlorophenyl)methylsulfonyl]-N-[3-(1-piperidinyl)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[(2,6-dichlorophenyl)methylsulfonyl]-N-(3-piperidin-1-ylpropyl)piperidine-4-carboxamide Traditional Name: 1-(2,6-dichlorobenzyl)sulfonyl-N-(3-piperidinopropyl)isonipecotamide Formula: C21H31Cl2N3O3S MolecularWeight: 476.46014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1CCN(CC1)CCCNC(=O)C2CCN(CC2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H31Cl2N3O3S/c22-19-6-4-7-20(23)18(19)16-30(28,29)26-14-8-17(9-15-26)21(27)24-10-5-13-25-11-2-1-3-12-25/h4,6-7,17H,1-3,5,8-16H2,(H,24,27)