4-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]cyclopentane-1,3-dione

Systemtic Name: 4-[1-(phenylmethyl)sulfonylpyrrolidin-2-yl]cyclopentane-1,3-dione Openeye Name: 4-(1-benzylsulfonylpyrrolidin-2-yl)cyclopentane-1,3-dione CAS Name: 4-[1-(phenylmethyl)sulfonyl-2-pyrrolidinyl]cyclopentane-1,3-dione IUPAC Name: 4-(1-benzylsulfonylpyrrolidin-2-yl)cyclopentane-1,3-dione Traditional Name: 4-(1-benzylsulfonylpyrrolidin-2-yl)cyclopentane-1,3-quinone Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3CC(=O)CC3=O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)CC2=CC=CC=C2)C3CC(=O)CC3=O

InChI

InChI=1S/C16H19NO4S/c18-13-9-14(16(19)10-13)15-7-4-8-17(15)22(20,21)11-12-5-2-1-3-6-12/h1-3,5-6,14-15H,4,7-11H2