phenyl 4-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate

Systemtic Name: phenyl 4-[(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylamino]benzoate Openeye Name: phenyl 4-[[2-chloro-5-(1-piperidylsulfonyl)benzoyl]amino]benzoate CAS Name: 4-[[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]benzoic acid phenyl ester IUPAC Name: phenyl 4-[(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(2-chloro-5-piperidinosulfonyl-benzoyl)amino]benzoic acid phenyl ester Formula: C25H23ClN2O5S MolecularWeight: 498.97852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23ClN2O5S/c26-23-14-13-21(34(31,32)28-15-5-2-6-16-28)17-22(23)24(29)27-19-11-9-18(10-12-19)25(30)33-20-7-3-1-4-8-20/h1,3-4,7-14,17H,2,5-6,15-16H2,(H,27,29)