N-(4-butylphenyl)-1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H28Cl2N2O3S/c1-2-3-4-17-5-8-20(9-6-17)26-23(28)19-11-13-27(14-12-19)31(29,30)16-18-7-10-21(24)22(25)15-18/h5-10,15,19H,2-4,11-14,16H2,1H3,(H,26,28)