4-methoxy-4-oxidanylidene-2-(3-phenylpropanoylamino)butanoic acid

Systemtic Name: 4-methoxy-4-oxidanylidene-2-(3-phenylpropanoylamino)butanoic acid Openeye Name: 4-methoxy-4-oxo-2-(3-phenylpropanoylamino)butanoic acid CAS Name: 4-methoxy-4-oxo-2-[(1-oxo-3-phenylpropyl)amino]butanoic acid IUPAC Name: 4-methoxy-4-oxo-2-(3-phenylpropanoylamino)butanoic acid Traditional Name: 2-(hydrocinnamoylamino)-4-keto-4-methoxy-butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)O)NC(=O)CCC1=CC=CC=C1

Isomeric SMILES

COC(=O)CC(C(=O)O)NC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C14H17NO5/c1-20-13(17)9-11(14(18)19)15-12(16)8-7-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,15,16)(H,18,19)