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

Systemtic Name: 1-[[2,6-bis(chloranyl)phenyl]methylsulfonyl]-N-(4-butylphenyl)piperidine-3-carboxamide Openeye Name: N-(4-butylphenyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide CAS Name: N-(4-butylphenyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]-3-piperidinecarboxamide IUPAC Name: N-(4-butylphenyl)-1-[(2,6-dichlorophenyl)methylsulfonyl]piperidine-3-carboxamide Traditional Name: N-(4-butylphenyl)-1-(2,6-dichlorobenzyl)sulfonyl-nipecotamide Formula: C23H28Cl2N2O3S MolecularWeight: 483.45102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C23H28Cl2N2O3S/c1-2-3-6-17-10-12-19(13-11-17)26-23(28)18-7-5-14-27(15-18)31(29,30)16-20-21(24)8-4-9-22(20)25/h4,8-13,18H,2-3,5-7,14-16H2,1H3,(H,26,28)