3-cyano-2-oxidanylidene-3-(3-phenoxyphenyl)propanoic acid

Systemtic Name: 3-cyano-2-oxidanylidene-3-(3-phenoxyphenyl)propanoic acid Openeye Name: 3-cyano-2-oxo-3-(3-phenoxyphenyl)propanoic acid CAS Name: 3-cyano-2-oxo-3-(3-phenoxyphenyl)propanoic acid IUPAC Name: 3-cyano-2-oxo-3-(3-phenoxyphenyl)propanoic acid Traditional Name: 3-cyano-2-keto-3-(3-phenoxyphenyl)propionic acid Formula: C16H11NO4 MolecularWeight: 281.26284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)C(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)C(C#N)C(=O)C(=O)O

InChI

InChI=1S/C16H11NO4/c17-10-14(15(18)16(19)20)11-5-4-8-13(9-11)21-12-6-2-1-3-7-12/h1-9,14H,(H,19,20)