(3S)-3-[(6-oxidanylidenepyran-3-yl)carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: (3S)-3-[(6-oxidanylidenepyran-3-yl)carbonylamino]-3-phenyl-propanoic acid Openeye Name: (3S)-3-[(6-oxopyran-3-carbonyl)amino]-3-phenyl-propanoic acid CAS Name: (3S)-3-[[oxo-(6-oxo-3-pyranyl)methyl]amino]-3-phenylpropanoic acid IUPAC Name: (3S)-3-[(6-oxopyran-3-carbonyl)amino]-3-phenylpropanoic acid Traditional Name: (3S)-3-[(6-ketopyran-3-carbonyl)amino]-3-phenyl-propionic acid Formula: C15H13NO5 MolecularWeight: 287.26742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)C2=COC(=O)C=C2

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)O)NC(=O)C2=COC(=O)C=C2

InChI

InChI=1S/C15H13NO5/c17-13(18)8-12(10-4-2-1-3-5-10)16-15(20)11-6-7-14(19)21-9-11/h1-7,9,12H,8H2,(H,16,20)(H,17,18)/t12-/m0/s1