phenacyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: phenacyl 2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: phenacyl 2-chloro-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-chloro-5-(1-pyrrolidinylsulfonyl)benzoic acid phenacyl ester IUPAC Name: phenacyl 2-chloro-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-chloro-5-pyrrolidinosulfonyl-benzoic acid phenacyl ester Formula: C19H18ClNO5S MolecularWeight: 407.86792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)OCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18ClNO5S/c20-17-9-8-15(27(24,25)21-10-4-5-11-21)12-16(17)19(23)26-13-18(22)14-6-2-1-3-7-14/h1-3,6-9,12H,4-5,10-11,13H2