2-oxidanylidenepropyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: 2-oxidanylidenepropyl 4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: acetonyl 4-chloro-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(1-pyrrolidinylsulfonyl)benzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 4-chloro-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-chloro-3-pyrrolidinosulfonyl-benzoic acid acetonyl ester Formula: C14H16ClNO5S MolecularWeight: 345.79854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(=O)COC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C14H16ClNO5S/c1-10(17)9-21-14(18)11-4-5-12(15)13(8-11)22(19,20)16-6-2-3-7-16/h4-5,8H,2-3,6-7,9H2,1H3