2,4-bis(chloranyl)-5-[4-(phenylcarbamoyl)piperidin-1-yl]sulfonyl-benzoic acid

Systemtic Name: 2,4-bis(chloranyl)-5-[4-(phenylcarbamoyl)piperidin-1-yl]sulfonyl-benzoic acid Openeye Name: 2,4-dichloro-5-[[4-(phenylcarbamoyl)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 5-[[4-[anilino(oxo)methyl]-1-piperidinyl]sulfonyl]-2,4-dichlorobenzoic acid IUPAC Name: 2,4-dichloro-5-[4-(phenylcarbamoyl)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 2,4-dichloro-5-[4-(phenylcarbamoyl)piperidino]sulfonyl-benzoic acid Formula: C19H18Cl2N2O5S MolecularWeight: 457.32762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C(=C3)C(=O)O)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2)S(=O)(=O)C3=C(C=C(C(=C3)C(=O)O)Cl)Cl

InChI

InChI=1S/C19H18Cl2N2O5S/c20-15-11-16(21)17(10-14(15)19(25)26)29(27,28)23-8-6-12(7-9-23)18(24)22-13-4-2-1-3-5-13/h1-5,10-12H,6-9H2,(H,22,24)(H,25,26)