[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 4-chloranyl-3-methylsulfonyl-benzoate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 4-chloranyl-3-methylsulfonyl-benzoate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 4-chloro-3-methylsulfonyl-benzoate CAS Name: 4-chloro-3-methylsulfonylbenzoic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 4-chloro-3-methylsulfonylbenzoate Traditional Name: 4-chloro-3-mesyl-benzoic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C18H16ClNO5S MolecularWeight: 393.84134

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)N3CCCC3=O)Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)N3CCCC3=O)Cl

InChI

InChI=1S/C18H16ClNO5S/c1-26(23,24)16-11-12(4-9-15(16)19)18(22)25-14-7-5-13(6-8-14)20-10-2-3-17(20)21/h4-9,11H,2-3,10H2,1H3