ethyl 2-[[1-[(3-chlorophenyl)methylsulfonyl]piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: ethyl 2-[[1-[(3-chlorophenyl)methylsulfonyl]piperidin-4-yl]carbonylamino]benzoate Openeye Name: ethyl 2-[[1-[(3-chlorophenyl)methylsulfonyl]piperidine-4-carbonyl]amino]benzoate CAS Name: 2-[[[1-[(3-chlorophenyl)methylsulfonyl]-4-piperidinyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[1-[(3-chlorophenyl)methylsulfonyl]piperidine-4-carbonyl]amino]benzoate Traditional Name: 2-[[1-(3-chlorobenzyl)sulfonylisonipecotoyl]amino]benzoic acid ethyl ester Formula: C22H25ClN2O5S MolecularWeight: 464.9623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H25ClN2O5S/c1-2-30-22(27)19-8-3-4-9-20(19)24-21(26)17-10-12-25(13-11-17)31(28,29)15-16-6-5-7-18(23)14-16/h3-9,14,17H,2,10-13,15H2,1H3,(H,24,26)