(3-benzamidophenyl) 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (3-benzamidophenyl) 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (3-benzamidophenyl) 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid (3-benzamidophenyl) ester IUPAC Name: (3-benzamidophenyl) 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid (3-benzamidophenyl) 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)OC3=CC=CC(=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OC3=CC=CC(=C3)NC(=O)C4=CC=CC=C4

InChI

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