butyl 4-[[1-[(3,4-dichlorophenyl)methylsulfonyl]piperidin-3-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-[(3,4-dichlorophenyl)methylsulfonyl]piperidin-3-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(3,4-dichlorophenyl)methylsulfonyl]-3-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-[(3,4-dichlorophenyl)methylsulfonyl]piperidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3,4-dichlorobenzyl)sulfonylnipecotoyl]amino]benzoic acid butyl ester Formula: C24H28Cl2N2O5S MolecularWeight: 527.46052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN(C2)S(=O)(=O)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C24H28Cl2N2O5S/c1-2-3-13-33-24(30)18-7-9-20(10-8-18)27-23(29)19-5-4-12-28(15-19)34(31,32)16-17-6-11-21(25)22(26)14-17/h6-11,14,19H,2-5,12-13,15-16H2,1H3,(H,27,29)