2-(phenylcarbonyloxy)ethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-(phenylcarbonyloxy)ethyl 2-chloranyl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: 2-benzoyloxyethyl 2-chloro-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-chloro-5-(1-piperidinylsulfonyl)benzoic acid 2-benzoyloxyethyl ester IUPAC Name: 2-benzoyloxyethyl 2-chloro-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-piperidinosulfonyl-benzoic acid 2-benzoyloxyethyl ester Formula: C21H22ClNO6S MolecularWeight: 451.92048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCOC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22ClNO6S/c22-19-10-9-17(30(26,27)23-11-5-2-6-12-23)15-18(19)21(25)29-14-13-28-20(24)16-7-3-1-4-8-16/h1,3-4,7-10,15H,2,5-6,11-14H2