[(2-chlorophenyl)-(3-methoxy-5-oxidanylidene-2H-furan-2-yl)methyl] 2-azanyl-3-phenyl-propanoate hydrobromide

Systemtic Name: [(2-chlorophenyl)-(3-methoxy-5-oxidanylidene-2H-furan-2-yl)methyl] 2-azanyl-3-phenyl-propanoate hydrobromide Openeye Name: [(2-chlorophenyl)-(3-methoxy-5-oxo-2H-furan-2-yl)methyl] 2-amino-3-phenyl-propanoate hydrobromide CAS Name: 2-amino-3-phenylpropanoic acid [(2-chlorophenyl)-(3-methoxy-5-oxo-2H-furan-2-yl)methyl] ester hydrobromide IUPAC Name: [(2-chlorophenyl)-(3-methoxy-5-oxo-2H-furan-2-yl)methyl] 2-amino-3-phenylpropanoate hydrobromide Traditional Name: 2-amino-3-phenyl-propionic acid [(2-chlorophenyl)-(5-keto-3-methoxy-2H-furan-2-yl)methyl] ester hydrobromide Formula: C21H21BrClNO5 MolecularWeight: 482.75214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)OC1C(C2=CC=CC=C2Cl)OC(=O)C(CC3=CC=CC=C3)N.Br

Isomeric SMILES

COC1=CC(=O)OC1C(C2=CC=CC=C2Cl)OC(=O)C(CC3=CC=CC=C3)N.Br

InChI

InChI=1S/C21H20ClNO5.BrH/c1-26-17-12-18(24)27-20(17)19(14-9-5-6-10-15(14)22)28-21(25)16(23)11-13-7-3-2-4-8-13;/h2-10,12,16,19-20H,11,23H2,1H3;1H