[4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3-azanylpropanoate chloride

Systemtic Name: [4-oxidanylidene-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3-azanylpropanoate chloride Openeye Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3-aminopropanoate chloride CAS Name: 3-aminopropanoic acid [4-oxo-3-phenoxy-2-(trifluoromethyl)-1-benzopyran-7-yl] ester chloride IUPAC Name: [4-oxo-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] 3-aminopropanoate chloride Traditional Name: 3-aminopropionic acid [4-keto-3-phenoxy-2-(trifluoromethyl)chromen-7-yl] ester chloride Formula: C19H14ClF3NO5- MolecularWeight: 428.76637

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CCN)C(F)(F)F.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)CCN)C(F)(F)F.[Cl-]

InChI

InChI=1S/C19H14F3NO5.ClH/c20-19(21,22)18-17(27-11-4-2-1-3-5-11)16(25)13-7-6-12(10-14(13)28-18)26-15(24)8-9-23;/h1-7,10H,8-9,23H2;1H/p-1