[2-chloranyl-5-(2-fluoranylethanoylamino)phenyl] hydrogen sulfate; 2-methylpropane

Systemtic Name: [2-chloranyl-5-(2-fluoranylethanoylamino)phenyl] hydrogen sulfate; 2-methylpropane Openeye Name: [2-chloro-5-[(2-fluoroacetyl)amino]phenyl] hydrogen sulfate; isobutane CAS Name: 2-methylpropane; sulfuric acid [2-chloro-5-[(2-fluoro-1-oxoethyl)amino]phenyl] ester IUPAC Name: [2-chloro-5-[(2-fluoroacetyl)amino]phenyl] hydrogen sulfate; 2-methylpropane Traditional Name: isobutane; sulfuric acid [2-chloro-5-[(2-fluoroacetyl)amino]phenyl] ester Formula: C12H17ClFNO5S MolecularWeight: 341.783483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C.C1=CC(=C(C=C1NC(=O)CF)OS(=O)(=O)O)Cl

Isomeric SMILES

CC(C)C.C1=CC(=C(C=C1NC(=O)CF)OS(=O)(=O)O)Cl

InChI

InChI=1S/C8H7ClFNO5S.C4H10/c9-6-2-1-5(11-8(12)4-10)3-7(6)16-17(13,14)15;1-4(2)3/h1-3H,4H2,(H,11,12)(H,13,14,15);4H,1-3H3