2-oxidanylpropyl 3-azanyl-2-fluoranyl-4-[2-(2-methylpropanoylamino)ethyl]benzoate hydrochloride

Systemtic Name: 2-oxidanylpropyl 3-azanyl-2-fluoranyl-4-[2-(2-methylpropanoylamino)ethyl]benzoate hydrochloride Openeye Name: 2-hydroxypropyl 3-amino-2-fluoro-4-[2-(2-methylpropanoylamino)ethyl]benzoate hydrochloride CAS Name: 3-amino-2-fluoro-4-[2-[(2-methyl-1-oxopropyl)amino]ethyl]benzoic acid 2-hydroxypropyl ester hydrochloride IUPAC Name: 2-hydroxypropyl 3-amino-2-fluoro-4-[2-(2-methylpropanoylamino)ethyl]benzoate hydrochloride Traditional Name: 3-amino-2-fluoro-4-[2-(isobutyrylamino)ethyl]benzoic acid 2-hydroxypropyl ester hydrochloride Formula: C16H24ClFN2O4 MolecularWeight: 362.824163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCC1=C(C(=C(C=C1)C(=O)OCC(C)O)F)N.Cl

Isomeric SMILES

CC(C)C(=O)NCCC1=C(C(=C(C=C1)C(=O)OCC(C)O)F)N.Cl

InChI

InChI=1S/C16H23FN2O4.ClH/c1-9(2)15(21)19-7-6-11-4-5-12(13(17)14(11)18)16(22)23-8-10(3)20;/h4-5,9-10,20H,6-8,18H2,1-3H3,(H,19,21);1H