(E)-2-(ethynylamino)-5-oxidanylidene-5-phenylmethoxy-pent-3-enoic acid

Systemtic Name: (E)-2-(ethynylamino)-5-oxidanylidene-5-phenylmethoxy-pent-3-enoic acid Openeye Name: (E)-5-benzyloxy-2-(ethynylamino)-5-oxo-pent-3-enoic acid CAS Name: (E)-2-(ethynylamino)-5-oxo-5-phenylmethoxy-3-pentenoic acid IUPAC Name: (E)-2-(ethynylamino)-5-oxo-5-phenylmethoxypent-3-enoic acid Traditional Name: (E)-5-benzoxy-2-(ethynylamino)-5-keto-pent-3-enoic acid Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

C#CNC(C=CC(=O)OCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

C#CNC(/C=C/C(=O)OCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H13NO4/c1-2-15-12(14(17)18)8-9-13(16)19-10-11-6-4-3-5-7-11/h1,3-9,12,15H,10H2,(H,17,18)/b9-8+