2-oxidanylidenepropyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 2-oxidanylidenepropyl 4-bromanyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: acetonyl 4-bromo-3-morpholinosulfonyl-benzoate CAS Name: 4-bromo-3-(4-morpholinylsulfonyl)benzoic acid 2-oxopropyl ester IUPAC Name: 2-oxopropyl 4-bromo-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-bromo-3-morpholinosulfonyl-benzoic acid acetonyl ester Formula: C14H16BrNO6S MolecularWeight: 406.24894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(=O)COC(=O)C1=CC(=C(C=C1)Br)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C14H16BrNO6S/c1-10(17)9-22-14(18)11-2-3-12(15)13(8-11)23(19,20)16-4-6-21-7-5-16/h2-3,8H,4-7,9H2,1H3