[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl] 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl] 4-chloranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: [2-oxo-2-(4-phenoxyanilino)ethyl] 4-chloro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)benzoic acid [2-oxo-2-(4-phenoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenoxyanilino)ethyl] 4-chloro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-piperidinosulfonyl-benzoic acid [2-keto-2-(4-phenoxyanilino)ethyl] ester Formula: C26H25ClN2O6S MolecularWeight: 529.0045

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)Cl

InChI

InChI=1S/C26H25ClN2O6S/c27-23-14-9-19(17-24(23)36(32,33)29-15-5-2-6-16-29)26(31)34-18-25(30)28-20-10-12-22(13-11-20)35-21-7-3-1-4-8-21/h1,3-4,7-14,17H,2,5-6,15-16,18H2,(H,28,30)